MCULE-4793937131 |
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C(C)(C)(CCCCCCCCCCC(C)(C)CC(=O)O)CC(=O)O |
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MCULE-1513008382 |
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MCULE-4708388805 |
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MCULE-5437143540 |
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MCULE-3207729356 |
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MCULE-6272236651 |
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C(CCCCCCCCCC(=O)O)[C@H](C)CC |
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MCULE-5735580085 |
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CCC(CCCCC(O)=O)C |
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MCULE-9187669622 |
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MCULE-1071013190 |
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CCCCCCCCC(CC(O)=O)C |
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MCULE-5185634901 |
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MCULE-9724986024 |
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MCULE-8051469418 |
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MCULE-1735950995 |
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MCULE-9671122893 |
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MCULE-4312256740 |
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MCULE-3587613382 |
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MCULE-6010456842 |
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MCULE-9603867941 |
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C(CCCCC(=O)O)CCCCCCCCCO |
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MCULE-5601308035 |
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MCULE-3378566421 |
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MCULE-5900954615 |
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MCULE-3254150931 |
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MCULE-3210783287 |
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MCULE-6938770128 |
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MCULE-4093240509 |
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MCULE-7197861669 |
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MCULE-3945412548 |
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CCCCCC(C(O)=O)C(C)C |
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MCULE-9581263473 |
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MCULE-9215293129 |
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MCULE-3771681317 |
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MCULE-1752034684 |
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MCULE-5127577640 |
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MCULE-5686478683 |
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MCULE-6121514710 |
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MCULE-9357391090 |
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MCULE-8232897652 |
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MCULE-1430959106 |
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MCULE-8934614150 |
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MCULE-7546735332 |
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MCULE-4716241218 |
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CCC(C(O)=O)(CCC(C)C)C |
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MCULE-6923368995 |
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CC1(C(O)=O)CCCCCCC1 |
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MCULE-1531878545 |
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MCULE-4062514314 |
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MCULE-1306261101 |
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CC(CCCCCC(=O)O)(C)C |
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MCULE-4476618510 |
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MCULE-8941673168 |
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MCULE-8431505935 |
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MCULE-7144406547 |
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MCULE-2098828387 |
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MCULE-8192564811 |
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MCULE-3831811055 |
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CCCCCC(C(=O)O)C |
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MCULE-2748338407 |
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CCCCC(CCC(=O)O)CC |
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MCULE-3460494679 |
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MCULE-1380155289 |
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MCULE-2717280848 |
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MCULE-1361949901 |
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MCULE-8259958688 |
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MCULE-7270362706 |
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MCULE-3151935797 |
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MCULE-4637509445 |
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MCULE-9106518461 |
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MCULE-5299092348 |
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MCULE-8094468025 |
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MCULE-2888473872 |
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MCULE-3769146629 |
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MCULE-6667030670 |
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MCULE-9180879585 |
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MCULE-1517131616 |
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MCULE-4185159932 |
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MCULE-7886858957 |
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MCULE-3942492343 |
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MCULE-8172997568 |
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MCULE-7655272143 |
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MCULE-2592304646 |
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MCULE-2945357825 |
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MCULE-8555526333 |
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MCULE-6960063747 |
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MCULE-7351642049 |
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MCULE-5703679612 |
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MCULE-2066533125 |
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CCCCCC(CC(O)=O)C |
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MCULE-4777686649 |
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CCCCCCC(CC(O)=O)C |
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MCULE-8250703770 |
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MCULE-4303741112 |
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MCULE-4048515589 |
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MCULE-9191627113 |
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MCULE-6191845705 |
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MCULE-6422981718 |
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MCULE-8631552684 |
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MCULE-2753582455 |
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MCULE-7572073631 |
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MCULE-3907306935 |
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MCULE-4806310815 |
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MCULE-3085282351 |
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MCULE-6954381114 |
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MCULE-8623857142 |
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MCULE-3463709825 |
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MCULE-8200495932 |
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MCULE-6453713560 |
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MCULE-4060617838 |
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MCULE-5193957469 |
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MCULE-6216368990 |
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MCULE-2795129925 |
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MCULE-9255156956 |
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MCULE-3914949169 |
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MCULE-4736597375 |
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MCULE-3088988040 |
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C(O)(C(C)CCCCCCCCCCCC)=O |
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MCULE-6377253083 |
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CCCCCCC(C(O)=O)CC |
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MCULE-7307915460 |
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MCULE-6036635794 |
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MCULE-9552597130 |
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CC(CCCCC(=O)O)C |
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MCULE-2198601753 |
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CCCCCCCCCC(CC(=O)O)C |
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MCULE-6934503036 |
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CC(CCCCCC(O)=O)C |
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MCULE-7728669545 |
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CCCCCC(C(O)=O)(C)C |
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MCULE-8286567269 |
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CC(CCCCC(=O)O)(C)C |
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MCULE-6664640382 |
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CCCCCCC(C(O)=O)C |
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MCULE-7220278799 |
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MCULE-1489137568 |
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MCULE-3935675049 |
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MCULE-9827668199 |
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MCULE-9203558568 |
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MCULE-7182880008 |
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MCULE-6207970958 |
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MCULE-4717498477 |
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MCULE-8603570043 |
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MCULE-3612456700 |
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CCCCC(CC(O)=O)CC |
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MCULE-4418670403 |
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MCULE-2797848894 |
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MCULE-7100044750 |
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MCULE-1366505263 |
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CCCCCCC(C(O)=O)(CC)C |
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CCCCCCC(C(O)=O)(CC)CC |
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MCULE-9122814153 |
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CCCCCCC(C(O)=O)(CCC)C |
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MCULE-3086618486 |
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MCULE-4147611614 |
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MCULE-4067913342 |
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MCULE-5435336580 |
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MCULE-8634297667 |
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MCULE-4790339661 |
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MCULE-3703948906 |
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MCULE-3886990507 |
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MCULE-6642298773 |
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MCULE-3515775261 |
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MCULE-1839591073 |
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MolPort-001-783-113 |
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MolPort-004-288-372 |
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CCCC(CC(O)=O)CCC |
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CCCCCC(C(O)=O)(CC)C |
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MCULE-3397559485 |
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MCULE-1123889262 |
0.95 |
CCC1C(C(C(O)=O)C)CCCCC1 |
|
MCULE-3920525824 |
0.95 |
C12(CC3CC(C)(CC(C3)(CC(O)=O)C1)C2)CC(O)=O |
|
MCULE-4967984413 |
0.95 |
C(O)(CC1(CCCC1)C)=O |
|
MCULE-4320686287 |
0.95 |
C1(CC(=O)O)CC(C(O)=O)C1(C)C |
|
MCULE-8249292238 |
0.95 |
C(CCCC1CCCCC1)(O)=O |
|
MCULE-8596451214 |
0.95 |
CC(C1C(CC(O)=O)CCCCC1)C |
|
MCULE-6572964179 |
0.95 |
C1(C(O)=O)C(C1)CCCCCCCC |
|
MCULE-2597081845 |
0.95 |
CC(C1C(C(C(O)=O)C)CCCCC1)C |
|
MCULE-7036927394 |
0.95 |
CC1C(CC(O)=O)CCCCC1 |
|
MCULE-9819507221 |
0.95 |
CC(C(O)=O)C1C(C)CCCCC1 |
|
MCULE-2720595773 |
0.95 |
[Na+].C(CCCCCCCCC)([O-])=O |
|
MCULE-8227046407 |
0.95 |
[Na+].C(CCCCCCC)([O-])=O |
|
MCULE-1073323432 |
0.95 |
CC([C@H]1[C@H](C(O)=O)C[C@@H](C)CC1)C |
|
MCULE-8933410348 |
0.95 |
CC1(CC2(CC(C(O)=O)C2)C1)C |
|
MCULE-1448060038 |
0.95 |
CCC[C@H]1[C@H](C(O)=O)C1 |
|
MCULE-4898217604 |
0.95 |
C1C[C@]2(C(CC[C@@](O)([C@@H]2CC[C@H](C)CC(O)=O)C)C(C1)(C)C)C |
|
MCULE-7367162008 |
0.95 |
CC(C[C@H]1[C@H](C(O)=O)C1)C |
|
MCULE-1417799876 |
0.95 |
C(C)(C)(CC(C)(C)CC(O)=O)C(O)=O |
|
MCULE-7150660975 |
0.95 |
C(O)(=O)C[C@@H]1CC[C@H](O)CC1 |
|
MCULE-6448726765 |
0.95 |
C1(C(O)=O)C(C1)CCCCCCCCCC |
|
MCULE-5146752612 |
0.95 |
CC(C1CCCCC1)CC(O)=O |
|
MCULE-2987899692 |
0.95 |
[Na+].C(CCCCCC([O-])=O)CCCCCCCCCCC |
|
MCULE-7933263354 |
0.95 |
CCCCC(C)C(=O)O |
|
MCULE-6771932074 |
0.95 |
CC1(C(CC(O)=O)CCCC1)C |
|
MCULE-8902130861 |
0.95 |
C(O)(CC1CC(C(O)C)C1(C)C)=O |
|
MCULE-6576387277 |
0.95 |
C(O)(=O)C1CC(C1)CCCCC |
|
MCULE-8509527472 |
0.95 |
OC(CCC1CC(=O)C1)=O |
|
MCULE-1239882099 |
0.95 |
CCC1(C(O)=O)CCCCC1 |
|
MCULE-9202536119 |
0.95 |
C(O)(=O)CCCCCO |
|
MCULE-5804605224 |
0.95 |
CCC(C1C(C(O)=O)C1)(C)C |
|
MCULE-5936435361 |
0.95 |
C1(CCCCC1CCCCCCCCCCC(O)=O)=O |
|
MCULE-8177394227 |
0.95 |
CC1CC(CC(O)=O)CCC1 |
|
MCULE-4197673100 |
0.95 |
CCC(C1C(C)(C)C1C(O)=O)(C)C |
|
MCULE-8685057779 |
0.95 |
O=C1C(CCCC(O)=O)CCC(C)(C)C1 |
|
MCULE-8081896644 |
0.95 |
C1CC2C(C(=O)O)CC(C)C2C1 |
|
MCULE-7809780622 |
0.95 |
CCC[C@@H]1CC[C@@H](C(=O)O)CC1 |
|
MCULE-2003543384 |
0.95 |
CC([C@@H]1CC[C@@H](C(O)=O)CC1)C |
|
MCULE-8769705518 |
0.95 |
OC(C1CC2C(CCCC2)CC1)=O |
|
MCULE-6249269089 |
0.95 |
C([O-])(=O)CCCCCCCCCCCCCCCCC.[K+] |
|
MCULE-7882506747 |
0.95 |
CC1(CCCCC1)CC(O)=O |
|
MCULE-3770906513 |
0.95 |
C1C(C(O)=O)CC(CC(=O)O)CC1 |
|
MCULE-9345456808 |
0.95 |
[O-]C(C(CC)CCCC)=O.[Na+] |
|
MCULE-9835494412 |
0.95 |
CCCC1(C(O)=O)CC2(CCC2)C1 |
|
MCULE-9614200331 |
0.95 |
C(CCCCCCC([O-])=O)CCCCCCCCCCCCCC.[Na+] |
|
MCULE-8377291972 |
0.95 |
CC(C(O)=O)(C1CCCCC1)C |
|
MCULE-2970673848 |
0.95 |
C1C2([H])CCC3([H])CC(C(O)=O)C([H])(C23[H])C1 |
|
MCULE-4425753830 |
0.95 |
C(O)(C12CC3(CC(O)=O)CC(C1)CC(C3)C2)=O |
|
MCULE-3316441062 |
0.95 |
CC([C@H]1[C@@H](C(O)=O)CCCC1)(C)C |
|
MCULE-3302391414 |
0.95 |
C(O)(CCCCCC)CCCCCCCCCCC([O-])=O.[Li+] |
|
MCULE-6634735984 |
0.95 |
[C@H]1(C(O)=O)[C@H](C1)CCC |
|
MCULE-4306276668 |
0.95 |
[K+].C(CCC([O-])=O)CCCCCCCC |
|
MCULE-1933467839 |
0.95 |
C(C)(CCC(O)=O)(C(C)C1CCCCC1)CC(O)=O |
|
MCULE-5864042542 |
0.95 |
C12CCC3C(C3CCC1C2C(O)=O)C(O)=O |
|
MCULE-5737299312 |
0.95 |
C1(CCCC)CC1C(=O)O |
|
MCULE-3684801033 |
0.95 |
OC(CCC1C2CCC(CC2)C1)=O |
|
MCULE-6405828438 |
0.95 |
O=C(C(CCCC)CC)[O-].[K+] |
|
MCULE-5185886916 |
0.95 |
CC(C(O)=O)CC1C2CCC(CC2)C1 |
|
MCULE-9334034494 |
0.95 |
[Na+].[Na+].O=C(CC(CCCCCCCCCCC(CC(=O)[O-])(C)C)(C)C)[O-] |
|
MCULE-8997456647 |
0.95 |
C1(CC2C(CCC2)C1)C(O)=O |
|
MCULE-6599303223 |
0.95 |
O=C(CCCCCCCCCCCCCCCCC)[O-].[Li+] |
|
MCULE-1912808272 |
0.95 |
C1(C)(C)CCCC1CC(O)=O |
|
MCULE-5840393222 |
0.95 |
CCC(C(O)=O)C1CCC(C)CC1 |
|
MCULE-6835808948 |
0.95 |
C(O)(CC(C)CC(C)(C)C)=O |
|
MCULE-9651818545 |
0.95 |
[C@@H]1(C(O)=O)C[C@H](C)CC[C@H]1C(C)C |
|
MCULE-1344194777 |
0.95 |
O=C(O)CCCCCCCC(O)C(O)CCCCCCCC |
|
MCULE-3584192725 |
0.95 |
CC1(C(O)=O)CCCCCC1 |
|
MCULE-4414065035 |
0.95 |
CC1CC(C(O)=O)CC(C)C1 |
|
MCULE-7271238373 |
0.95 |
[C@@H]1(C(O)=O)[C@@H](C1)CCC |
|
MCULE-4037231044 |
0.95 |
C(C1CCC(C(O)=O)CC1)C(C)C |
|
MCULE-4581534617 |
0.95 |
C12(CC3CC(CC(C3)C1)C2)C(O)=O |
|
MCULE-6508170743 |
0.95 |
C12(CC3CC(CC(C)(C3)C1)(C)C2)CC(O)=O |
|
MCULE-3132418894 |
0.95 |
C(O)(=O)C1CCC(CC1)CC |
|
MCULE-5247114904 |
0.95 |
C(C1(CCC(C(=O)O)([H])CC1)[H])CCC |
|
MCULE-1644298562 |
0.90 |
C(=O)(CCCC(=O)O)CCCC(=O)O |
|
MCULE-1210295340 |
0.90 |
CC1(C(C(O)=O)C1)CC1CCCC1 |
|
MCULE-7188499918 |
0.90 |
C1(O)CCCCCCCCCCC1=O |
|
MCULE-3163376531 |
0.90 |
OC(C1CC2(CCCCC2)C1)=O |
|
MCULE-4183602278 |
0.90 |
C1(CC2C(CC(CC2)O)C1)C(O)=O |
|
MCULE-3072060660 |
0.90 |
OC(C1CC(=O)CCCCC1)=O |
|
MCULE-7094313530 |
0.90 |
OC(CC1C2(CCCC2)CC1)=O |
|
MCULE-1009846890 |
0.90 |
OC(C1C2(C(C3CC3)CCCC2)C1)=O |
|
MCULE-4399154195 |
0.90 |
C(O)(=O)C1CC(C1)CC |
|
MCULE-3182628740 |
0.90 |
C([O-])(=O)CCCCC([O-])=O.[Ag+].[Ag+] |
|
MCULE-6415159340 |
0.90 |
C(O)(C1CCCC1)=O |
|
MCULE-6674707395 |
0.90 |
OC(C12C3CC(CC3)C1CCC2)=O |
|
MCULE-5173796359 |
0.90 |
OC(C1C(C2CCCCC2)C1)=O |
|
MCULE-7783755862 |
0.90 |
CC(C1(C(C(O)=O)C1)C)C |
|
MCULE-6572346778 |
0.90 |
O=C(O)C(O)CCCCCCCCCCCCCC |
|
MCULE-5242343531 |
0.90 |
C(CCCC(CCCCCCCCCCCC)=O)(O)=O |
|
MCULE-9971131265 |
0.90 |
[H]C12CCCCC1(C)C(C(C1CCC(C(C)CCC(O)=O)C1(C)C(O)=O)CC2)C(O)=O |
|
MCULE-4265422019 |
0.90 |
[H]C12CC(O)CCC1(C)C1C(CC3(C)C(CCC3C(C)C(O)=O)C1CC2)=O |
|
MCULE-4825961688 |
0.90 |
CCCCCC(CC(O)=O)O |
|
MCULE-1828310186 |
0.90 |
O=C1CCC2(C)C3CC(C4(C)C(C(C)CCC(O)=O)CCC4C3CCC2(C1)[H])=O |
|
MCULE-8431350287 |
0.90 |
[H]C12CCCCC1(C)C1CC(C3(C)C(C(C)CCC(O)=O)CCC3C1CC2)=O |
|
MCULE-6158448589 |
0.90 |
[H]C12CCCCC1(C)C1CCC3(C)C(C(C)CCC(O)=O)CCC3C1CC2 |
|
MCULE-8474228842 |
0.90 |
C(O)(C1CCC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CCC2(C1)[H])=O |
|
MCULE-1657466953 |
0.90 |
[C@]12(C)CCC3[C@@]([H])(CC[C@@]4([H])C[C@H](O)CC[C@]34C)C1CC[C@@H]2[C@H](C)CCC(O)=O |
|
MCULE-2184723738 |
0.90 |
C12(CCC(C1(C)C)C2)C(O)=O |
|
MCULE-2377526300 |
0.90 |
OC(C1CC2(CCCC2)C1)=O |
|
MCULE-6929900712 |
0.90 |
OC(CC1CCC2(CC2)CC1)=O |
|
MCULE-5681027073 |
0.90 |
OC(C(C1CCCCCC1)C1CC1)=O |
|
MCULE-8944777861 |
0.90 |
CC[C@H]1[C@H](C(O)=O)C1 |
|
MCULE-5388440569 |
0.90 |
[H]C12CC(O)CCC1(C)C1CCC3(C)C(CCCC3C1CC2)=O |
|
MCULE-8362534875 |
0.90 |
C12(CC3CCC(CC(C3)C1)C2)C(O)=O |
|
MCULE-4984630376 |
0.90 |
CC1CCC(C2(C(O)=O)CC2)CC1 |
|
MCULE-6806538778 |
0.90 |
CCCCC(CCC(O)=O)O |
|
MCULE-8412103796 |
0.90 |
C12(CCC(C(C)(C)C1C)C2)C(O)=O |
|
MCULE-2869965950 |
0.90 |
CCC1C2(C(C(O)=O)C2)CCCCC1 |
|
MCULE-4492465897 |
0.90 |
C12(CCCC(C1)C(O)=O)CC2 |
|
MCULE-8004614755 |
0.90 |
C1(CCCCCCC1O)(C)C(O)=O |
|
MCULE-6285352175 |
0.90 |
OC(C1C2(CCCC2)C1)=O |
|
MCULE-6914691591 |
0.90 |
OC(CC1C2(CCCCC2)CC1)=O |
|
MCULE-1487409845 |
0.90 |
[Na+].CCCCCCCCC(C(CCCCCCCC(=O)[O-])O)O |
|
MCULE-3393759799 |
0.90 |
C1(O)CCC2(C)C3CC(O)C4(C)C(C(C)CCC(=O)O)CCC4C3CCC2C1 |
|
MCULE-1352377374 |
0.90 |
CC(C(=O)O)C1CCC1 |
|
MCULE-8371895709 |
0.90 |
C(O)(=O)CC(O)CCC(C)CC |
|
MCULE-8054557225 |
0.90 |
C(O)(CC(=O)O)CCCCCCCCC |
|
MCULE-4092969179 |
0.90 |
C(CC(O)CC(=O)O)CCCCCCCCCCCCC |
|
MCULE-4151749430 |
0.90 |
C(O)(C(CCCCC)O)=O |
|
MCULE-4470175604 |
0.90 |
C(O)(C1CC2C(C)(C)C(C2)C1C)=O |
|
MCULE-4404267434 |
0.90 |
OC([C@@H]1[C@@H]2[C@H]1CCCCC2)=O |
|
MCULE-4228389293 |
0.90 |
C1(C(O)=O)C(C)C(C1)C |
|
MCULE-5577030984 |
0.90 |
C1C[C@@]2([H])[C@]3(C)CC[C@@]4(C)[C@]5([H])C[C@](C)(CO)CC[C@]5(C)CC[C@]4(C)[C@@]3([H])CC[C@]2(C)[C@@H](C)C1=O |
|
MCULE-7141144115 |
0.90 |
C1(C)(CCC(O)=O)CC1 |
|
MCULE-5513451934 |
0.90 |
C(O)(=O)C(C1CCC1)CC1CC1 |
|
MCULE-8532386971 |
0.90 |
OC(CC1CCC2(CCCC2)CC1)=O |
|
MCULE-3720911045 |
0.90 |
OC(CC1CCC1)=O |
|
MCULE-5265679391 |
0.90 |
CC(C(O)=O)C1C2(CCCC2)CC1 |
|
MCULE-8238049678 |
0.90 |
O=C1C(O)CCCCCCCC1 |
|
MCULE-7281082037 |
0.90 |
C(CCCC(CCCCCCCCCC)=O)(O)=O |
|
MCULE-8501061021 |
0.90 |
C1(CC2(C1)CCC(CC2)=O)C(O)=O |
|
MCULE-5892857696 |
0.90 |
CC1C2(C(C)(C)C2C(O)=O)CCCCC1 |
|
MCULE-4803320183 |
0.90 |
CC1C2(C(C(O)=O)C2)CCCCC1 |
|
MCULE-5450508349 |
0.90 |
CC(C12CC(C1)C2)C(=O)O |
|
MCULE-8295862879 |
0.90 |
OC(CC1CCC(C2CCC2)CC1)=O |
|
MCULE-7495383968 |
0.90 |
CC1(C2(C(C(O)=O)CC1CC2)C)C |
|
MCULE-2430887278 |
0.90 |
[Na+].C([O-])(C1CCCCC1)=O |
|
MCULE-3471588131 |
0.90 |
C1(CC2C(CC(CC2)=O)C1)C(O)=O |
|
MCULE-3804470410 |
0.90 |
CC(C1C2(C(C(O)=O)C2)CCCCC1)C |
|
MCULE-2008468853 |
0.90 |
OC(C1C2(CCC3(CC3)CC2)C1)=O |
|
MCULE-3585071606 |
0.90 |
CC(C(O)=O)C1C(C2CC2)CCCC1 |
|
MCULE-2319800478 |
0.90 |
C1(CC)(CC)CC1C(O)=O |
|
MCULE-2035957255 |
0.90 |
OC(CC1C(C2CC2)CCCC1)=O |
|
MCULE-5542945732 |
0.90 |
CC(C1C(C)(C)C1C(O)=O)(C)C |
|
MCULE-8991511326 |
0.90 |
CC(=O)C(CCCC)CO |
|
MCULE-4016461466 |
0.90 |
OC1CCCC(=O)CCC1 |
|
MCULE-4099946993 |
0.90 |
CC1(C(C(=O)O)CC1)C |
|
MCULE-2553099876 |
0.90 |
[C@@]12(C)[C@@]([H])([C@H](C)CCC(O)=O)CC[C@@]1([H])[C@]1([C@@]([H])([C@@]3(C)CC[C@H](C[C@]3(CC1)[H])O)C[C@@H]2O)[H] |
|
MCULE-2503310018 |
0.90 |
OC(C1C2(CCCCC2)C1)=O |
|
MCULE-4932955141 |
0.90 |
C(O)(=O)[C@H](O)CCCCCCCC(O)=O |
|
MCULE-1131796379 |
0.90 |
OC([C@H]1[C@@H]2[C@@H](CCCCC2)C1)=O |
|
MCULE-9978136872 |
0.90 |
CC1(CC(C(O)=O)CC1)C |
|
MCULE-8613374918 |
0.90 |
C1(O)CCCCCCCCCCCCCC1=O |
|
MCULE-6908272845 |
0.90 |
C1(CC(C1)C1CCCC1)C(O)=O |
|
MCULE-4298027549 |
0.90 |
CC(C1C(C(O)=O)C1)C |
|
MCULE-2993174891 |
0.90 |
C1(C(O)=O)C(C1)CC |
|
MCULE-2755332087 |
0.90 |
CC1C(C(O)=O)CC1 |
|
MCULE-2328305728 |
0.90 |
C1(CCCCCCCCCCCCCCC1O)=O |
|
MCULE-4756542974 |
0.90 |
C(C(O)CC(=O)O)CCCCCCCCCC |
|
MCULE-5754568032 |
0.90 |
OC(C(C1CCCCC1)C1CCC1)=O |
|
MCULE-6470944503 |
0.90 |
C(O)(CCC(CCCCCCCC)O)=O |
|
MCULE-4116947583 |
0.90 |
OC(C(C1CCCCC1)C1CC1)=O |
|
MCULE-5374557832 |
0.90 |
CC1(C(=O)O)C2CC(CC2)C1 |
|
MCULE-3576727807 |
0.90 |
CC(C(O)=O)C1C2(CCCCC2)CC1 |
|
MCULE-4794343339 |
0.90 |
C12(C)C(C(C)CCC(O)=O)CCC1([H])C1C(C3(C)CCC(CC3(CC1)[H])O)CC2=O |
|
MCULE-3373480454 |
0.90 |
C12C3C4C5C6C(=O)C4C1C1CCCC1C2C(CO)C3C5CC6 |
|
MCULE-6091123641 |
0.90 |
C1(CC2C(CCCC2)C1)C(O)=O |
|
MCULE-9495078126 |
0.90 |
[Na+].C(C([O-])=O)CCCC |
|
MCULE-8214280044 |
0.90 |
OC(C(C1CCCCCC1)C1CCC1)=O |
|
MCULE-6153315236 |
0.90 |
C12(CCC(C1(C)C)(C)C2)C(O)=O |
|
MCULE-7268643143 |
0.90 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@H]([C@H](C)CCC(=O)O)CC[C@@]4([H])[C@]3([H])CC[C@]2([H])C[C@@H]1O |
|
MCULE-1445414038 |
0.90 |
C(C(O)CC(=O)O)CCCCCCCCCCCC |
|
MCULE-7044635718 |
0.90 |
CC1([C@@]2(C(O)=O)CC[C@@H]1CC2)C |
|
MCULE-8037408561 |
0.90 |
C(O)(CCC(CCCCCCCC)=O)=O |
|
MCULE-1311278982 |
0.90 |
C12(CCC(C(C)C1(C)C)C2)C(O)=O |
|
MCULE-1781204332 |
0.90 |
C12(C)CCC3C(CCC4([H])CC(O)CCC34C)C1CCC2C(C)CCC(O)=O |
|
MCULE-4706733913 |
0.90 |
C1(CCCC1CCCCCCCCCCCO)=O |
|
MCULE-5907126944 |
0.90 |
CCC1(C(C(O)=O)C1)C |
|
MCULE-1878585748 |
0.90 |
C1(CCCCC1CCCCCCCCCCCO)=O |
|
MCULE-5591309975 |
0.90 |
C(O)(CCC(CCCCCC)O)=O |
|
MCULE-8150530718 |
0.90 |
CC1(C(O)=O)CCCC1 |
|
MCULE-3170300171 |
0.90 |
CCCCCCCC(=O)CC(O)=O |
|
MCULE-3507603615 |
0.90 |
OC(C1C2(CCC2)CCCC1)=O |
|
MCULE-3191980261 |
0.90 |
C1C(CCC(=O)O)(CC(O)=O)C1 |
|
MCULE-4056750992 |
0.90 |
C(CCC(=O)O)C(=O)CCCCCC |
|
MCULE-4126818812 |
0.90 |
CCC(C1CC1)CC(O)=O |
|
MCULE-2016332390 |
0.90 |
OCCC1CCC(=O)CC1 |
|
MCULE-9658695246 |
0.90 |
C12(CCC(CC1)C)CC2C(O)=O |
|
MCULE-9397608140 |
0.90 |
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MCULE-5718207273 |
0.90 |
C1(CCCCCCCCCCC1CCC(O)=O)=O |
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MCULE-9174492631 |
0.90 |
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MCULE-2105378214 |
0.90 |
C1(CC2CC1CC2)C(O)=O |
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MCULE-5287861470 |
0.90 |
[C@]12(C)CC[C@]3([C@@]([H])(CC[C@@]4([H])C[C@@H](O)CC[C@]34C)[C@]1([H])CC[C@]2([H])CC(O)=O)[H] |
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MCULE-2412559497 |
0.90 |
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MCULE-3470675948 |
0.90 |
O=C(O)C1CC(C(C)C)C1 |
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MCULE-3123393545 |
0.90 |
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MCULE-5526835762 |
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MCULE-2427095523 |
0.90 |
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MCULE-5339221610 |
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MCULE-1156283256 |
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O=C(CCCCCCCC(=O)CCC(O)=O)O |
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MCULE-2648252385 |
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C12(C)CCC(CC1CC(O)=O)C2(C)C |
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MCULE-4783030711 |
0.90 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@]([C@@H](CCC(O)=O)C)([H])CC[C@@]4([H])[C@]3([H])CC[C@]2([H])C[C@@H]1O |
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MCULE-1648013865 |
0.90 |
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MCULE-6755051379 |
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MCULE-8810404854 |
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MCULE-5257530891 |
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MCULE-4855956223 |
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MCULE-1864252195 |
0.90 |
C(C(C)C)(C(O)=O)C(O)CC(C)C |
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MCULE-5122422025 |
0.90 |
OC(C1C2(CCC2)C1)=O |
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MCULE-4908457545 |
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MCULE-8726903905 |
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CCCC(CC(O)=O)(CCC)O |
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MCULE-5253122006 |
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C[C@@H]([C@@H]1[C@]2(C)[C@H]([C@H]3[C@H](C[C@@H]2O)[C@]2(C)[C@@H](C[C@@H](CC2)O)CC3)CC1)CCC(=O)O |
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MCULE-7766469470 |
0.90 |
C(CCC(=O)CC([O-])=O)CCCCCCCCCCCCCCCCCC |
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MCULE-9902521392 |
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CC1(C(CC2CCCC2)(C)C1C(O)=O)C |
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MCULE-4727842865 |
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OC(C1(CC2(CCC2)C1)CC1CC1)=O |
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MCULE-3436491291 |
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C(CCC)(CCC(O)=O)(CCC(O)=O)C(C)=O |
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MCULE-3602802796 |
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MCULE-9754037363 |
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MCULE-7919400845 |
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MCULE-9292131587 |
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MCULE-8429241976 |
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C12(C)CC(C(O)=O)C(CC1)C2(C)C |
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MCULE-4828153043 |
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MCULE-2319491493 |
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C12CC(CC1C(O)=O)C2(C)C |
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MCULE-7337930692 |
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MCULE-1679305682 |
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C(O)(C(=O)O)CCCCCC |
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MCULE-7183792222 |
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C(C(CCCC(=O)O)=O)CCCC |
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MCULE-8287083462 |
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MCULE-7440208948 |
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CC1(C2(CCC3(CC3)CC2)C1C(O)=O)C |
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MCULE-4360629497 |
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C(O)(=O)CC(CCCCCCC)O |
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MCULE-5205208596 |
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MCULE-3076062318 |
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CC1(C2CC(CC2)C1C(O)=O)C |
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MCULE-6741385258 |
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MCULE-9954859815 |
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CCC(CCCC(=O)O)=O |
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MCULE-4809633073 |
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C(CC)C(=O)CCC(=O)O |
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MCULE-5554652459 |
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MCULE-9050492488 |
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MCULE-5171743084 |
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C(CC(O)C(=O)O)CCCCCCCC |
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MCULE-5009837194 |
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CC1CC(C(O)=O)CC1 |
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MCULE-1233637144 |
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MCULE-9530736167 |
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MCULE-9862158900 |
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OC(=O)C[C@H](O)CCCCCCCCC |
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MCULE-8278468713 |
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C(O)(=O)CC(CCCCCC)O |
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MCULE-7974855017 |
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MCULE-5264826892 |
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MCULE-4119867593 |
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C(=O)(O)C(O)CCCCCCCC(=O)O |
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MCULE-5875777622 |
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C1(C)(CCC(O)=O)C(CCC(O)=O)CCC2C3C(C)(CCC12)CCC3 |
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MCULE-7536199519 |
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C(O)(=O)C(CC)C(=O)CCC |
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MCULE-8929530363 |
0.90 |
C12(C)CCC(C(CC(O)=O)C1)C2(C)C |
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MCULE-2789377761 |
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CC(C(O)=O)C1CCC(C2CCC2)CC1 |
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MCULE-2258535093 |
0.90 |
CC(C(O)=O)(C1CCC1)C |
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MCULE-4653275903 |
0.90 |
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MCULE-8798412985 |
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C(CCCC(CCCCCCCCCCC(O)=O)=O)(O)=O |
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MCULE-2186257830 |
0.90 |
C(C)(CCC(O)=O)(CCC(O)=O)C(C)=O |
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MCULE-3450412893 |
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C1C2(CCC(C(O)=O)CC2)CC1 |
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MCULE-8689766454 |
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MCULE-9062188980 |
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MCULE-6422028108 |
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C1C2(CCC(O)CC2)CCC(=O)C1 |
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MCULE-2441976800 |
0.90 |
CC(C(O)=O)C1CCC2(CC2)CC1 |
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MCULE-8369309534 |
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MCULE-9838734871 |
0.90 |
C1C2(CCC(C(O)=O)CC2)C1 |
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MCULE-6791529668 |
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MCULE-3993690922 |
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CC1CC(C(O)=O)(C2CC(C)CCC2)C1 |
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MCULE-3279478733 |
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MCULE-8352063977 |
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MCULE-1377442346 |
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OC(CCC1CC1)=O |
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MCULE-4997016680 |
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O=CCCCCCO |
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MCULE-8986413010 |
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CC(CC(C(=O)O)CC(C)C)C |
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MCULE-7136317196 |
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CCCC(C(O)=O)CCC |
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MolPort-046-764-724 |
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MolPort-044-723-808 |
0.89 |
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MolPort-046-417-791 |
0.89 |
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MolPort-046-764-724 |
0.89 |
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MolPort-003-850-152 |
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MolPort-003-850-151 |
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MolPort-003-850-150 |
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MolPort-003-850-149 |
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MolPort-006-147-910 |
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MolPort-046-416-834 |
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CC(=O)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C |
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MolPort-044-723-808 |
0.89 |
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MolPort-046-416-834 |
0.89 |
CC(=O)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C |
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MolPort-046-417-791 |
0.89 |
[2H]C([2H])([2H])C(=O)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C |
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MCULE-8310250581 |
0.86 |
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MCULE-3221627320 |
0.86 |
CC(C=O)(CC1C2CCC(CC2)C1)O |
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MCULE-7157392758 |
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C12(C)CCC(CC1C(O)CC1C3C(C)(C(CC3)C(C)CCC(O)=O)CCC12)O |
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MCULE-7030357253 |
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MCULE-6867752922 |
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MCULE-5457069948 |
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MCULE-2653982818 |
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CCCC1CCC(C(O)=O)(O)CC1 |
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MCULE-7859411819 |
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CC1CC(C(O)=O)(C2C3CC(CC3)C2)C1 |
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MCULE-3838245802 |
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MCULE-8592697908 |
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MCULE-9639307076 |
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C12(C)C([H])(C(C)CCC(O)=O)CCC1([H])C1(C([H])(C3(C)CCC(CC3(CC1O)[H])O)CC2O)[H] |
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MCULE-8803525726 |
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MCULE-4430782133 |
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CC1C(CC(O)=O)(O)CCCCC1 |
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MCULE-3243206773 |
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MCULE-3613551080 |
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OC(C1C2CCC(CC2)C1)CC=O |
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MCULE-5661638563 |
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C1(C)(C)[C@](C[C@]1(C(C)=O)[H])(C(O)=O)[H] |
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MCULE-3360072331 |
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CC(C(O)=O)C(C1C2CCC(CC2)C1)O |
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MCULE-5729772657 |
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MCULE-9447631047 |
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C1C[C@]2(C)[C@@]3([H])C[C@H](O)[C@]4(C)[C@@H]([C@H](C)C[C@@H](C)C(O)=O)CC[C@@]4([H])[C@]3([H])[C@H](O)[C@H](CC)[C@]2([H])C[C@@H]1O |
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MCULE-1722457669 |
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CC1C(C(C(O)=O)O)CCCCC1 |
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MCULE-1471598195 |
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OC(C(O)=O)C1CCCC1 |
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MCULE-7711081081 |
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MCULE-9943982137 |
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MCULE-4654071539 |
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CC(C(O)=O)CC1CC2C(C2)C1 |
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MCULE-9062474189 |
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CCCCCCC(C(O)=O)C(=O)O |
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MCULE-7323691528 |
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MCULE-8104320792 |
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MCULE-4205911962 |
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MCULE-4067052677 |
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MCULE-9153902276 |
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CC(C(O)=O)(CC1CC2C(C2)C1)C |
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MCULE-4953623682 |
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MCULE-8093957599 |
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MCULE-1310305344 |
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MCULE-5916019409 |
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MCULE-4387871536 |
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MCULE-4692930106 |
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[C@@]123CC[C@]4([C@@](C)(CCC[C@@]4(C)C(O)=O)[C@]1([H])CC[C@@](C(=O)C2)(C)C3)[H] |
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MCULE-2218780681 |
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C12C(=O)C3CC4C5CC(CC1C5C3)(O)CC42 |
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MCULE-5412550293 |
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C(O)(=O)C(C)(CCCC(C)(C)O)O |
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MCULE-1729016821 |
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MCULE-3017983928 |
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MCULE-3158579605 |
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MCULE-3334513103 |
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MCULE-7525939705 |
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MCULE-6696855762 |
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MCULE-8822456730 |
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MCULE-6215487775 |
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MCULE-6359824984 |
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CC(C(O)=O)(CC1CC2C(C2)CC1)C |
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MCULE-3366018643 |
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OCC(C(O)=O)C1CCCCCC1 |
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MCULE-3268045048 |
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MCULE-5324734485 |
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MCULE-1137791149 |
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MCULE-9576516239 |
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MCULE-6932837620 |
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C12(C3CC(CC(C3)C1)C2)C(=O)O |
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MCULE-1523208411 |
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MCULE-4155057370 |
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O[C@H]1C[C@@H]2[C@@]3(C)CC[C@H](C[C@H]3C[C@@H]([C@H]2[C@@H]2CC[C@H]([C@H](C)CCC(=O)O)[C@]21C)O)O |
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MCULE-8065311815 |
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MCULE-2107446858 |
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C1(C(O)=O)CC2C3CC(C(=O)O)CC3C2C1 |
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MCULE-7646723801 |
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C1(=O)CC(C(=O)O)CCCC1 |
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MCULE-4923930414 |
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C12(CC(C1)=O)CC(C2)(CO)CO |
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MCULE-8634032188 |
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[C@@]12([H])CC[C@H]([C@H](C)CCC(=O)O)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CC[C@@H](O)C[C@@]3([H])CC(=O)[C@@]21[H] |
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MCULE-7459037200 |
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MCULE-6653280663 |
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CC(CC1C(=O)CCC1)(CO)C |
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MCULE-2498129200 |
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MCULE-2872066455 |
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C1CC(CC(=O)O)C(=O)CC1 |
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MCULE-6191485166 |
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CC(C(O)=O)CC1CC2C(C2)CC1 |
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MCULE-2612102056 |
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C(CCCCCCCCC)(C(O)=O)C(O)=O |
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MCULE-5987413622 |
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[C@]12(C)CCC(C[C@]1([H])CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@@H]2O)C)=O |
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MCULE-3032434503 |
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CC1C(C(O)=O)CC2C(C2)C1 |
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MCULE-6811733269 |
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MCULE-9880770190 |
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CC1C(CCC=O)(O)CCCCC1 |
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MCULE-9455931681 |
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C1(C)(C)C(C)(C=O)CCC1C(O)=O |
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MCULE-2557585903 |
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MCULE-8611525083 |
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MCULE-5802470514 |
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C12(C)C([H])(C(C)CCC(O)=O)CCC1([H])C1(C([H])(C3(C)CCC(CC3(CC1=O)[H])=O)CC2=O)[H] |
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MCULE-1725445424 |
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C(CCC)C(C(O)=O)(C(O)=O)CCCC |
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MCULE-4617210772 |
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C12(C)CCC3(C([H])(C(=O)CC4([H])CC(=O)CCC34C)C1([H])CCC2C(C)CCC(O)=O)[H] |
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MCULE-7032345049 |
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[C@@]12(C)[C@@]([H])([C@H](C)CCC(O)=O)CC[C@@]1([H])[C@]1([C@@]([H])([C@@]3(C)CC[C@H](C[C@]3(C[C@H]1O)[H])O)C[C@@H]2O)[H] |
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MCULE-7582955995 |
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MCULE-7330224392 |
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MCULE-7831785324 |
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CC12C(=O)CC3(C1)C(C1(C)C(CC3)C(C(O)=O)(C)CCC1)CC2 |
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MCULE-3308182794 |
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CC(C(C)=O)C1C(O)(C)CCCC1 |
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MCULE-3526946316 |
0.86 |
C12(C)C(C(C)CCC(=O)[O-])CCC1([H])C1(C([H])(C3(C)CCC(CC3(CC1)[H])O)CC2O)[H].[Na+] |
|
MCULE-5689039654 |
0.86 |
CC(CC(C(O)=O)CCC(O)=O)C |
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MCULE-4295713715 |
0.86 |
C(CCCCC)(C(O)=O)C(O)=O |
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MCULE-7278733419 |
0.86 |
CC([C@]1(CC[C@@]2([C@@]1(CC[C@]1([C@]2(CC[C@]2([C@@]1(CC[C@](O)(C)C2)[H])[H])[H])[H])C)[H])[H])=O |
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MCULE-2427640787 |
0.86 |
C(CCCCCCCCCC)(C(O)=O)C(O)=O |
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MCULE-7988753662 |
0.86 |
C(O)(=O)C(CCC)CC(C)=O |
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MCULE-3409243062 |
0.86 |
C(CCCCCCCC)(C(O)=O)C(O)=O |
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MCULE-9658779473 |
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MCULE-8255633701 |
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C(CC(=O)O)C(CCCCCC)C(=O)O |
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MCULE-7504539994 |
0.86 |
OC(CC1(CCCC1)O)=O |
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MCULE-8636111494 |
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MCULE-3188928859 |
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CC(C(O)=O)C1CC2CC(CC2)C1 |
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MCULE-3741637843 |
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CCCCCCC(C(O)=O)CC(=O)O |
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MCULE-6145821294 |
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CC(C1(C(O)=O)CC2(CCC2)C1)CO |
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MCULE-1055087889 |
0.86 |
[C@H]1(O)C[C@]2([H])[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H]([C@H](C)CC(O)=O)CC3)[C@@H](O)C2 |
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MCULE-8569034339 |
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MCULE-6257378779 |
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C1C[C@]2(C)[C@@]3([H])C[C@H](O)[C@]4(C)[C@@H]([C@H](C)C[C@H](C)C(O)=O)CC[C@@]4([H])[C@]3([H])[C@H](O)[C@H](CC)[C@]2([H])C[C@@H]1O |
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MCULE-8504861268 |
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C(O)(=O)C1(CCCCC1)O |
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MCULE-6286465037 |
0.86 |
C1C(O)(C)C(C)C(C(O)(C)CCCC(C(O)=O)C)C1 |
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MCULE-4496146206 |
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CC(C(CC1C2CCC(CC2)C1)=O)O |
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MCULE-6425588618 |
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C[C@@]1([C@H](C(O)=O)CCCC1)O |
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MCULE-4710449346 |
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MCULE-3558477364 |
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CC(C(CC1C2CCC(CC2)C1)=O)(O)C |
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MCULE-9576797353 |
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CC1(CC(C=O)(CO)CC(C)(C)C1)C |
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MCULE-6356306352 |
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CC1(C(C(=O)O)CCC(=O)C1)C |
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MCULE-7637251477 |
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MCULE-6983782266 |
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MCULE-3422507323 |
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MCULE-4032148565 |
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MCULE-6810385974 |
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MCULE-6610512478 |
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MCULE-3772278824 |
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CC1CC(CC(CO)(C)C)C(=O)CC1 |
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MCULE-5653162391 |
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MCULE-5584455342 |
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MCULE-8306152675 |
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MCULE-8161580793 |
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CC1C(C(O)=O)(O)CCCCC1 |
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MCULE-5633126153 |
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CC1(CC(C(=O)O)(O)CCC1)C |
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MCULE-1928231659 |
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MCULE-9335475635 |
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MCULE-4224119563 |
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MCULE-8272811754 |
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[Na+].[C@@]12(C)[C@@H]([C@H](C)CCC(=O)[O-])CC[C@@]1([H])[C@]1([C@@]([H])([C@@]3(C)CC[C@H](C[C@]3(CC1)[H])O)C[C@@H]2O)[H] |
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MCULE-3360247652 |
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MCULE-1918471657 |
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CC1C(=O)CCC(C(O)=O)C1 |
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MCULE-2089699013 |
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CC1(C(C(O)=O)C1C1CC2C(C2)CC1)C |
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MCULE-9641279057 |
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OC(C(O)=O)CC1CCCCC1 |
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MCULE-5331331752 |
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MCULE-4581279785 |
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MCULE-6324573231 |
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MCULE-5217139502 |
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[C@H]1(C(O)=O)CCC(=O)C[C@@H]1C |
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MCULE-4636386581 |
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MCULE-9768222609 |
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MCULE-7380509390 |
0.86 |
[Na+].O[C@H]1C[C@@H]2[C@@]3(C)CC[C@H](C[C@H]3CC[C@H]2[C@@H]2CC[C@H]([C@H](C)CCC(=O)[O-])[C@]21C)O |
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MCULE-9068909742 |
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OC1CC(C(O)=O)CCC1 |
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MCULE-6729438541 |
0.86 |
CC([C@H]1[C@@](O)(C)CCCC1)(C=O)C |
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MCULE-6960655075 |
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MCULE-2418944540 |
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MCULE-2038524800 |
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MCULE-5400491867 |
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MCULE-1824869604 |
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OCCC1(C(O)=O)CC2(CCC2)C1 |
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MCULE-7142319563 |
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CC(CC1C(=O)CCCCC1)(CO)C |
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MCULE-9890442572 |
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C12C(C1)CC(C(O)=O)C2 |
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MCULE-5343111314 |
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MCULE-2712906661 |
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MCULE-3434331295 |
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MCULE-9738014494 |
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MCULE-5035487716 |
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OC(C=O)CC1C2CCC(CC2)C1 |
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MCULE-4726169671 |
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CC[C@@H]1[C@H]2[C@@](CC[C@H](C2)O)(C)[C@@H]2[C@H]([C@H]3[C@@](CC2)(C)[C@@H]([C@@H](CCC(=O)O)C)CC3)[C@@H]1O |
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MCULE-8825622840 |
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C1CC2(C)C3CCC4C(C(=O)O)CC3(C4)CCC2C(C(=O)O)(C)C1 |
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MCULE-5465054616 |
0.86 |
C1(=O)CC(C(O)CC1C(C)(C)C)C(C)(C)C |
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MCULE-7945361619 |
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C12(C)CCC3C(CCC4CC(=O)CCC34C)C1CCC2(C)O |
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MCULE-1705333752 |
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MCULE-7858410602 |
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CC1(C(C(O)=O)C1C1CC2C(C2)C1)C |
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MCULE-3776577040 |
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CCCC[C@H](CO)C(=O)O |
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MCULE-2747094328 |
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MCULE-7291994692 |
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CC1(CCC(C(O)=O)(O)CC1)C |
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MCULE-2925676495 |
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CC1(C2(C3(CCCC3)CC2)C1C(O)=O)C |
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MCULE-2058177079 |
0.86 |
C1(O)(C(C)=O)C(C)CCC(C(C)C)C1 |
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MCULE-7729446908 |
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CC(C(C[C@H]1[C@@](O)(C)CCCC1)=O)C |
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MCULE-2555279569 |
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C[C@]12CC[C@@]3([H])[C@](CC[C@@]4([C@]3(C)CCC(=O)C4)[H])([H])[C@]1([H])CC[C@@H]2O |
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MCULE-3029974779 |
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CCC1C(C(O)=O)(O)CCCCC1 |
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MCULE-3867667251 |
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MCULE-5242713432 |
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C1C[C@@]2(C3CCC4C(CO)CC3(C4)CCC2[C@](C)(C1)C(=O)O)C |
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MCULE-5428373062 |
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MCULE-2976071300 |
0.86 |
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MCULE-6702830045 |
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MCULE-7544649275 |
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CCC(C(C)=O)C1C(O)(C)CCCC1 |
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MCULE-1700675888 |
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MCULE-6035774013 |
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MCULE-2891360225 |
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MCULE-3801434421 |
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CC1C(CC=O)(O)CCCCC1 |
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MCULE-2392362320 |
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CC1CCC(C(O)=O)(O)CC1 |
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MCULE-4505750030 |
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MCULE-1493453185 |
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MCULE-3421183878 |
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MCULE-2351809970 |
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MCULE-6250560834 |
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MCULE-8576194627 |
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MCULE-5033425758 |
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C1(CC2CC1CC2)C(O)=O.Cl[H] |
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MCULE-5939746375 |
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MCULE-8455721308 |
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C1(=O)C2CC(CC1CC(C(O)=O)C2)C |
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MCULE-2949323528 |
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C1(CCCCC1)[C@@H](O)C(=O)O |
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MCULE-8778544836 |
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MCULE-4029687060 |
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MCULE-6365374961 |
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CC(C1C(CC=O)(O)CCCCC1)C |
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MCULE-4992660180 |
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MCULE-7082436494 |
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MCULE-6613103459 |
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MCULE-8579431063 |
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MCULE-2621146934 |
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MCULE-4861873087 |
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MCULE-1425054597 |
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C[C@H](CCC(=O)O)[C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)[C@](C[C@@H](CC2)O)([H])[C@@H](CC)[C@H]3O)[H])([H])CC1 |
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MCULE-4374611501 |
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[C@]12(C)CC[C@]3([C@@]([H])([C@@H](O)C[C@]4([H])C[C@H](O)CC[C@]34C)[C@]1([H])CC[C@]2([H])[C@H](C)CCC(O)=O)[H] |
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MCULE-1847699321 |
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CC(=O)[C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)[C@@](C[C@@H](CC2)O)([H])CC3)[H])([H])CC1 |
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MCULE-4444168907 |
0.86 |
OCC1(C(O)=O)CC2(CCC2)C1 |
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MCULE-2200666200 |
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MCULE-1013257730 |
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OC(C1C2CCC(CC2)C1)CC(O)=O |
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MCULE-6522061959 |
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CC(C1C(CC(O)=O)(O)CCCCC1)C |
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MCULE-4358979995 |
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C1(CCCCC1C(C)=O)C(O)=O |
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MCULE-9685921085 |
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O[C@H]1[C@H](C(O)=O)CCCC1 |
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MCULE-4925971656 |
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C1(=O)C2CCCC1CC([H])(C(O)=O)C2 |
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MCULE-1612189543 |
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C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@H]([C@H](C)CCC(=O)O)CC[C@@]4([H])[C@]3([H])[C@H](O)C[C@]2([H])C[C@@H]1O |
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MCULE-8533691455 |
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MCULE-2229659445 |
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CC1(CCC(=O)CC1)O |
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MCULE-9730340934 |
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C(CCCCCCCCCCCO)(C(O)=O)C(O)=O |
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MCULE-7470096721 |
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MCULE-9895779131 |
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MCULE-7796922508 |
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MCULE-6437253717 |
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MCULE-8206008473 |
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OC(C(O)=O)C1CCCCCC1 |
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MCULE-3641341110 |
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CCC1CC(C(O)=O)(O)CC1 |
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MCULE-2461205614 |
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CC1CCC(C(O)=O)(O)CCC1 |
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MCULE-7250327068 |
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MCULE-2587545100 |
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CC1(CC(C(O)=O)(CO)CC(C)(C)C1)C |
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MCULE-7650537157 |
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CC1(C(C2C(=O)CCCC2)CCCC1)O |
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MCULE-1345678838 |
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MCULE-3860096148 |
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MCULE-1684765148 |
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MCULE-2536433460 |
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MCULE-6719700936 |
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MCULE-8870026883 |
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MCULE-1603817866 |
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MCULE-3402814140 |
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C[C@@]1([C@H](CC(O)=O)CCCC1)O |
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MCULE-7268034011 |
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C1CC2(C3CCC4C(CO)CC3(C4)CCC2C(C)(C1)C(=O)O)C |
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MCULE-9124111940 |
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MCULE-6445854186 |
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CC(CC(CCC(=O)O)=O)=O |
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MCULE-9135293799 |
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MCULE-6183947571 |
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CC(C1C(C(C(O)=O)O)CCCCC1)C |
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MCULE-2929328294 |
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C12(C(O)=O)CC3(C1(C)CCC23)C |
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MCULE-8633773099 |
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MCULE-8139501570 |
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C(C(CCCCCC)O)C(O)[C@H](CCCCCCCC(O)=O)O |
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MCULE-6625595981 |
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MCULE-7360611998 |
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CCC1C(CC=O)(O)CCCCC1 |
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MCULE-7579126986 |
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O[C@H]1[C@H](CC(O)=O)CCC1 |
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MCULE-8097065230 |
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C1(CCCC(CCC(=O)O)C1=O)CCC(=O)O |
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MCULE-9306266558 |
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C12(CC3CC(CC(C3)C1)C2)C(CCC(O)=O)=O |
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MCULE-1941504047 |
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C1(CC1)C(=O)CCC(=O)O |
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MCULE-8618287625 |
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MCULE-6322615838 |
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OC(C1C2(CCC(C3CCC3)CC2)C1)=O |
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MCULE-5851579880 |
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C12(CC3CC(CC(C3)C1)C2)C(C)(O)CC(O)=O |
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MCULE-2460783843 |
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[C@@H]1(C(O)=O)CCC(=O)C[C@H]1C |
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MCULE-6610747657 |
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C[C@]1([C@@]2([H])[C@]([C@]3(CC[C@]4(C[C@]3(CC2)CC4=O)C)[H])(C)CCC1)C(=O)O |
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MCULE-3728932412 |
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[C@H]1(C(O)=O)CCC[C@@H](O)C1 |
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MCULE-1509835362 |
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[C@@H]1(C(O)=O)CCC[C@H](O)C1 |
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MCULE-9072643820 |
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MCULE-9089777466 |
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MCULE-4294157743 |
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MCULE-6193557471 |
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MCULE-5732276352 |
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MCULE-6007001487 |
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MCULE-1406337947 |
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MCULE-3424436777 |
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MCULE-8679880554 |
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MCULE-8207399383 |
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MCULE-7184225269 |
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MCULE-3362779243 |
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MCULE-2282540668 |
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MCULE-6115049357 |
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MCULE-3123546954 |
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MCULE-8866498627 |
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MCULE-6556565861 |
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MCULE-7908301885 |
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MCULE-6935468570 |
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MCULE-7049598328 |
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MCULE-3881057082 |
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MCULE-1524081508 |
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MCULE-1848106804 |
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MCULE-8257059661 |
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MCULE-3978349845 |
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MCULE-3376996312 |
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MolPort-006-126-055 |
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MolPort-003-925-047 |
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MCULE-9430716320 |
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MCULE-1845982880 |
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MCULE-4011811531 |
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MCULE-3965249925 |
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CC(C(O)=O)(C1C2(CCCCC2)CC1)O |
|
MCULE-5672767343 |
0.83 |
[Na+].C[C@@H]([C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)[C@](C[C@@H](CC2)O)([H])C[C@H]3O)[H])([H])CC1)CCC(=O)[O-] |
|
MCULE-3114046336 |
0.83 |
C12(C)CCC(C(CC(O)=O)C1=O)C2(C)C |
|
MCULE-2383064816 |
0.83 |
C1(CC(O)=O)(C(O)=O)CCCC1(C)C |
|
MCULE-7871735686 |
0.83 |
[C@]1(C)(CC[C@@H](C(O)=O)C1(C)C)C(O)=O |
|
MCULE-8399847709 |
0.83 |
[C@@]1(C)(CC[C@H](C(O)=O)C1(C)C)C(O)=O |
|
MCULE-8327980560 |
0.83 |
CC(C1(C2(CCCC2)CC1)O)(C(O)=O)C |
|
MCULE-4848878024 |
0.83 |
OC(CC1(CCC2(CC2)CC1)O)=O |
|
MCULE-2839833978 |
0.83 |
OC(C12CC(CC1=O)CC2)=O |
|
MCULE-5717394365 |
0.83 |
OC(CCC1(CCC2(CC2)CC1)O)=O |
|
MCULE-3238931854 |
0.83 |
OC(C1CC(C2CCCCC2)(O)C1)=O |
|
MCULE-7839970640 |
0.83 |
[C@@]1(C)(CC[C@H](C(O)=O)C1(C)C)C(O)=O |
|
MCULE-4449782615 |
0.83 |
O=C(O)[C@@H]1CCC[C@@H](C(=O)O)C1 |
|
MCULE-3306746591 |
0.83 |
OC([C@@H]1C[C@H](C(O)=O)CCC1)=O |
|
MCULE-2023555109 |
0.83 |
C12(CC1(C)C(O)=O)CC2(C)C(O)=O |
|
MCULE-1653903179 |
0.83 |
C1(C(=O)O)C2CCC(CC2)C1C(=O)O |
|
MCULE-7695129098 |
0.83 |
C12CC(C(O)C1)CC2C(O)=O |
|
MCULE-6406845010 |
0.83 |
C1(C)(C)C(CCC1C(O)=O)C(O)=O |
|
MCULE-7617843574 |
0.83 |
C1(CCC(C)C1)(CC(=O)O)CC(=O)O |
|
MCULE-3098351650 |
0.83 |
[C@]12(C)CCC3C(CCC(=O)[C@]3(C)CCC(O)=O)C1CCC2[C@H](C)CCCC(C)C |
|
MCULE-5449345895 |
0.83 |
CC1CC(C(O)=O)C(C(O)=O)C1 |
|
MCULE-6923663809 |
0.83 |
[C@@H]1(C(O)=O)CCC[C@H]1C(O)=O |
|
MCULE-2389227142 |
0.83 |
C1[C@@H](O)CC[C@@](CC(=O)O)(O)C1 |
|
MCULE-2587764931 |
0.83 |
C1(CCC(C(=O)O)CC1)(CC(=O)O)CC(=O)O |
|
MCULE-2425344927 |
0.83 |
[H]C1(CCC2(C3CC(C4(C(C3C(CC2(C1)[H])(O)[H])CCC4(C(CCC([O-])=O)(C)[H])[H])C)(O)[H])C)O.[Na+] |
|
MCULE-5353614084 |
0.83 |
C[C@H](CCC(=O)[O-])[C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)[C@](C[C@@H](CC2)O)([H])C[C@@H]3O)[H])([H])CC1.[Na+] |
|
MCULE-6944198613 |
0.83 |
C12(CCC(C(C)(C)C1=O)C2)C(O)=O |
|
MCULE-9811591517 |
0.83 |
C1(C)(CC(O)=O)C(=O)CCC1=O |
|
MCULE-5673828578 |
0.83 |
CC1(C2(CC3CC(CC3)C2)C1C(O)=O)C |
|
MCULE-2928763866 |
0.83 |
C1(CCCC(C)C1)(CC(=O)O)CC(=O)O |
|
MCULE-9443303762 |
0.83 |
CC(C1(C2(CCCCC2)CC1)O)C(O)=O |
|
MCULE-3320078169 |
0.83 |
C12CC(CC1C(O)=O)C(=O)C2 |
|
MCULE-8329888745 |
0.83 |
C(C(=O)O)(C(=O)O)C1CCCC1 |
|
MCULE-6125603126 |
0.83 |
C(O)(=O)CCC1C(=O)CC[C@@]2(C)C1CCC2=O |
|
MCULE-6458890062 |
0.83 |
OC(C1C2(CC3CC(CC3)C2)C1)=O |
|
MCULE-7283682823 |
0.83 |
C12(CC(CC1)CC2O)C(O)=O |
|
MCULE-1446289266 |
0.83 |
C1(CC(C1)CCCC)(C(O)=O)C(O)=O |
|
MCULE-4564542009 |
0.83 |
OC1C2(C)C(C(CC(O)=O)C(C3(C)CCC(O)CC3=O)CC2)CC1 |
|
MCULE-1338202684 |
0.83 |
[C@@]1(C)(C[C@@](C)(C[C@](C)(C(O)=O)C1)C(O)=O)C(O)=O |
|
MCULE-1539151646 |
0.83 |
C1CCC(C(CC1)C(O)=O)C(O)=O |
|
MCULE-6451936436 |
0.83 |
C1C(C(O)=O)C(C(O)=O)CCC1CCCC(C)C |
|
MCULE-4214835076 |
0.83 |
C1(C)(CCC(C(O)=O)C1(C)C)C(O)=O |
|
MCULE-9413167290 |
0.83 |
C12(CCC(CC1O)C2(C)C)C(O)=O |
|
MCULE-1370613174 |
0.83 |
OC(C1C(C(O)=O)CCC1)=O |
|
MCULE-3346909877 |
0.83 |
[C@H]1(C(O)=O)CCCC[C@@H]1C(O)=O |
|
MCULE-8991394896 |
0.83 |
[C@]12(C(O)=O)C(C)(C)[C@]([H])(CC1)CC2=O |
|
MCULE-7456688560 |
0.83 |
C1(C)(C)C(C)C(CC1C(O)=O)C(O)=O |
|
MCULE-3475821180 |
0.83 |
C12(CCC(C1([H])C(C(O)=O)CC2)C(O)=O)[H] |
|
MCULE-3522338549 |
0.83 |
C1(CCCC1)(CC(O)=O)CC(O)=O |
|
MCULE-4906980900 |
0.83 |
[C@@H]1(C(O)=O)CCCC[C@H]1C(O)=O |
|
MCULE-2724317446 |
0.83 |
C1(CC(C(C)(C)C)CC(C(O)=O)C1)C(O)=O |
|
MCULE-9092645789 |
0.83 |
C12CC(CC1C(O)=O)CC2O |
|
MCULE-1913862273 |
0.83 |
O[C@H]1[C@@H](O)[C@H]2C[C@H](C[C@H](C(O)=O)C2)C1 |
|
MCULE-9235794463 |
0.83 |
C1(C)(C)C(C)(CCC1(C)C(O)=O)C(O)=O |
|
MCULE-3561865284 |
0.83 |
O=C(O)C1C(CC(C)CC1)C(O)=O |
|
MCULE-5010456389 |
0.83 |
OC(CC1(C2(CCCCC2)CC1)O)=O |
|
MCULE-1617735058 |
0.83 |
OC(C(O)=O)C1C2(CCCCC2)CC1 |
|
MCULE-2058287343 |
0.83 |
[Na+].OCC1(CCCCC1)CC([O-])=O |
|
MCULE-7718766921 |
0.83 |
OC(C1(C2CC(CC2)C1)O)=O |
|
MCULE-2751748723 |
0.83 |
[C@H]1(C(O)=O)CCC[C@H](C(O)=O)C1 |
|
MCULE-2254711716 |
0.83 |
C[C@@]1([C@H](C2(C(O)=O)CC2)CCCC1)O |
|
MCULE-3191585744 |
0.83 |
CC1(C(C2(C(O)=O)CC2)CCCC1)O |
|
MCULE-7394880278 |
0.83 |
C1(C)(CC(O)=O)C2CCC1(C)C(C2)O |
|
MCULE-4690990385 |
0.83 |
C1CCC2C(C(O)=O)C(C(O)=O)C3CCCCC3C2C1 |
|
MCULE-3244409567 |
0.83 |
OC(C(O)=O)C1C2(CCCC2)CC1 |
|
MCULE-4368075445 |
0.83 |
C(O)(=O)C.C(O)(=O)C.OC1C2(C)C(C(CC(O)=O)C(C3(C)CCC(O)CC3=O)CC2)CC1 |
|
MCULE-4388374834 |
0.83 |
C12(C(O)=O)CCCC(C1=O)CCCC2 |
|
MCULE-6341821631 |
0.83 |
C1(CC2(C1)CC1(C2)CC(C1)=O)(C(O)=O)C(O)=O |
|
MCULE-4782314892 |
0.83 |
OC(C1(C2(CCCC2)CC1)O)=O |
|
MCULE-4032658081 |
0.83 |
OC(C1(C2(CCCCC2)CC1)O)=O |
|
MCULE-7294774452 |
0.83 |
[Na+].[C@@]12([H])C[C@@H]([C@]3([H])C[C@H](O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])[C@H](C)CCC([O-])=O)O |
|
MCULE-2578057478 |
0.83 |
OC(CC1(C2(CCCC2)CC1)O)=O |
|
MCULE-7328521882 |
0.83 |
C1(CC(=O)O)(CC(=O)O)CCCCCC1 |
|
MCULE-5697334554 |
0.83 |
C1(CC2(C1)CC(C2)O)(C(O)=O)C(O)=O |
|
MCULE-5609850019 |
0.83 |
CC(C1(C2(CCCC2)CC1)O)C(O)=O |
|
MCULE-9461957149 |
0.83 |
C12C3C4CC1C1C2(C(O)=O)C3C41 |
|
MCULE-6310805409 |
0.83 |
OC(CCC1(C2(CCCC2)CC1)O)=O |
|
MCULE-9648528247 |
0.83 |
C12(CC3CC(CC(C3)C1)C2)C(C(O)=O)C(O)=O |
|
MCULE-8158708245 |
0.83 |
O=C(O)[C@@H]1CCC[C@@H](C(=O)O)C1 |
|
MCULE-3996975707 |
0.83 |
CC(C(O)=O)(C1C2(CCCC2)CC1)O |
|
MCULE-8905557970 |
0.83 |
[C@]12(C(=O)O)CC[C@]([H])(CC1=O)C2(C)C |
|
MCULE-4303833280 |
0.83 |
C(CC1CCC1)(C(O)=O)C(O)=O |
|
MCULE-1309179067 |
0.83 |
C12(C)CCC(C(=O)C1=O)C2(C)CCC(O)=O |
|
MCULE-9877784302 |
0.83 |
O=C(O)[C@@H]1C[C@H](C(=O)O)C[C@H](C(=O)O)C1 |
|
MCULE-6066809185 |
0.83 |
OC(CC1(CCCCC1)CC(O)=O)=O |
|
MCULE-9974933236 |
0.83 |
C1(CCCCC1=O)C(=O)CCC(=O)O |
|
MCULE-7528897218 |
0.83 |
OC(C1(CCC1)CC1CC2C(C2)C1)=O |
|
MCULE-7536148049 |
0.83 |
[C@@]12([H])C(=O)C[C@]3([H])CC(CC[C@]3(C)[C@@]1([H])CC(=O)[C@]1(C)[C@H](CC[C@@]21[H])[C@H](C)CCC([O-])=O)=O.[Na+] |
|
MCULE-2274617868 |
0.83 |
C12(CCC(C(C)(C)C1C=O)C2)C(O)=O |
|
MCULE-9601771232 |
0.83 |
C12CC(CC1C(O)=O)CC2=O |
|
MCULE-9946794209 |
0.83 |
C12(CCC(C(C)(C)C1CO)C2)C(O)=O |
|
MCULE-2410735377 |
0.83 |
C1(C(O)=O)(C(O)=O)CC1CCCCCCCC |
|
MCULE-8521080491 |
0.83 |
C12(CCC(C(C)(C)C1O)C2)C(O)=O |
|
MCULE-6907877071 |
0.83 |
[Na+].OC1(CCC1)CCC([O-])=O |
|
MCULE-4412989829 |
0.83 |
C12(CC3CC(CC)(CC(C3)(C(O)=O)C1)C2)C(O)=O |
|
MCULE-5053577261 |
0.83 |
C12(C)CCC(C(C(O)=O)C1O)C2(C)C |
|
MCULE-2154783360 |
0.83 |
CC(C1(C(C2CC2)CCCC1)O)C(O)=O |
|
MCULE-3928038199 |
0.83 |
OC(CC1(C(C2CC2)CCCC1)O)=O |
|
MCULE-6347358348 |
0.83 |
OC(C1(C(C2CC2)CCCC1)O)=O |
|
MCULE-7196171464 |
0.83 |
OC(C1CC(C(O)=O)CCC1)=O |
|
MCULE-3955505328 |
0.83 |
C1(CC(C1)CCC)(C(O)=O)C(O)=O |
|
MCULE-5700412565 |
0.83 |
C1(CC(C1)CC(C)C)(C(O)=O)C(O)=O |
|
MCULE-6069018267 |
0.83 |
C12(CCC(C1(C)C)(C=O)C2)C(O)=O |
|
MCULE-2210992451 |
0.83 |
CC1(C(O)=O)CC(C(O)=O)CCC1 |
|
MCULE-7262774135 |
0.83 |
C1(C(O)=O)(C(O)=O)C2C1CCCCCC2 |
|
MCULE-6204538129 |
0.83 |
CCC(C(O)=O)(C1C2(CCCC2)CC1)O |
|
MCULE-7693917962 |
0.83 |
[H]C12CC(O)CCC1(C)C1CC(O)C3(C)C(C(C)C(O)=O)CCC3C1CC2 |
|
MCULE-3358575308 |
0.83 |
CC1(C(C2(C(O)=O)CCC2)CCCC1)O |
|
MCULE-9147662538 |
0.83 |
CCC(C1(C2(CCCC2)CC1)O)C(O)=O |
|
MCULE-9956322297 |
0.83 |
CCC(C1(CCC2(CC2)CC1)O)C(O)=O |
|
MCULE-3717825499 |
0.83 |
C12(C)CCC(CC1=O)C2(C)CC(O)=O |
|
MCULE-4253750674 |
0.83 |
O=C1CC2(C)C(CCC2C2CCC3CC(O)CCC3(C)C12)C(O)=O |
|
MCULE-9986157056 |
0.83 |
C12C3CCC(C3)C1C2C(O)=O |
|
MCULE-2418790366 |
0.83 |
CC1CC(C(O)=O)(C2C(O)CCCC2)C1 |
|
MCULE-9442455281 |
0.83 |
[C@H]1(C(O)=O)CCC[C@H](C(O)=O)C1 |
|
MCULE-6505487662 |
0.83 |
CC1CC(C(O)=O)(C2C(O)CCC2)C1 |
|
MCULE-7747323415 |
0.83 |
[C@@H]1(C(O)=O)CCCC[C@H]1C(O)=O |
|
MCULE-2512006733 |
0.83 |
CC1CC(C(O)=O)(C2C(O)(C)CCC2)C1 |
|
MCULE-9703499208 |
0.83 |
C12(CCC(C(O)C1)(C)C2(C)C)CC(O)=O |
|
MCULE-6154591690 |
0.83 |
C1(CCCCC1)(CC(O)=O)C(O)=O |
|
MCULE-9506589203 |
0.83 |
[C@H]1(CCCC[C@@H]1C(O)=O)C(O)=O |
|
MCULE-2183676762 |
0.83 |
[Na+].[C@@]12(C)[C@@H]([C@H](C)CCC(=O)[O-])CC[C@@]1([H])[C@]1([C@@]([H])([C@@]3(C)CC[C@H](C[C@]3(C[C@H]1O)[H])O)C[C@@H]2O)[H] |
|
MCULE-1950757998 |
0.83 |
CC1([C@](C(=O)O)(C)CC[C@H]1C(=O)O)C |
|
MCULE-9459049733 |
0.83 |
C(O)(=O)CC1(C(O)=O)CCCC(C)(C)C1 |
|
MCULE-4004832628 |
0.82 |
O=C1CCC2(C)C3C(O)CC4(C)C(CCC4C3CCC2(C1)[H])C(C)=O |
|
MCULE-3544972262 |
0.82 |
O=C1CCC2(C)C3CCC4(C)C(CCC4C3CC(O)C2(C1)[H])C(C)=O |
|
MCULE-9720790774 |
0.82 |
[C@]12(C)C[C@@H](O)C3[C@@]([H])(CCC4CC(=O)CC[C@]34C)C1C[C@@H](C)[C@@H]2C(C)=O |
|
MCULE-9429187529 |
0.82 |
CC1(C(C2C(=O)CCC2)CCCC1)O |
|
MCULE-9256642523 |
0.82 |
O=C1CCCC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CCC21O |
|
MCULE-5756679964 |
0.82 |
CC1([C@@H]2[C@](C(C[C@H]1C2)=O)(O)C)C |
|
MCULE-2147028492 |
0.82 |
OC(C1(CCCC1)O)=O |
|
MCULE-5995051629 |
0.82 |
[H]C12CCCCC1(C)C1CCC3(C)C(C(O)CC3C1CC2)C(C)=O |
|
MCULE-5483181646 |
0.82 |
CC1C2(CC(CCC2)CC1=O)O |
|
MCULE-5660062778 |
0.82 |
[H]C12CC(O)CCC1(C)C1CCC3(C)C(C(C)CCCC(C)C)CCC3C1C(C2)=O |
|
MCULE-4019531420 |
0.82 |
[C@@]12([H])CC[C@H](C(=O)C)[C@@]1([H])[C@H](C(C)C)CC[C@]2(O)C |
|
MCULE-3496895499 |
0.82 |
[H]C12CCCCC1(C)C1C(O)CC3(C)C(CCC3C1CC2)C(C)=O |
|
MCULE-5352096496 |
0.82 |
CCCC(C([O-])=O)CCCO.[Na+] |
|
MCULE-9546669272 |
0.82 |
C[C@@]1([C@H](C2(C=O)CCC2)CCCC1)O |
|
MCULE-3066636390 |
0.82 |
O=C(C)C1CCC2C3CC(O)C45C(CCC4(C)C3CCC21C)C5 |
|
MCULE-7722587632 |
0.82 |
CC(CCCC([O-])=O)O.[Na+] |
|
MCULE-3449258177 |
0.82 |
C12CC(C1(C)C)CC(=O)C2(C)O |
|
MCULE-1306043247 |
0.82 |
[C@@]12([H])CC[C@@]3([H])CC(CCC3(C)[C@@]1([H])CCC1(C)[C@@](CC[C@@]21[H])(O)C(=O)C)=O |
|
MCULE-6308143690 |
0.82 |
CC1(C(C2(C=O)CCCC2)CCCC1)O |
|
MCULE-3986040492 |
0.82 |
C12(CO)CCC(=O)C[C@]1(C)CCC1C3CCC(=O)C3(CCC21)C |
|
MCULE-9236214878 |
0.82 |
[C@@]1(C)(C[C@@](C1)(CC)O)C(O)=O |
|
MCULE-2235494953 |
0.82 |
C12(CCCC(C1)CC(=O)C2)O |
|
MCULE-5534286219 |
0.82 |
[C@]1(C)(C[C@@](C1)(CC)O)C(O)=O |
|
MCULE-4493343687 |
0.82 |
C(CCCC)(C(O)=O)C(O)=O |
|
MCULE-9332320504 |
0.82 |
CC(CC(C(=O)O)CC(=O)O)(C)C |
|
MCULE-1126799973 |
0.82 |
CC(C1CC1)(CC(=O)O)O |
|
MCULE-3035503630 |
0.82 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@H]([C@@H](CC[C@H](C(C)C)O)C)CC[C@@]4([H])[C@]3([H])[C@H](O)C[C@@]2([H])CC1=O |
|
MCULE-5550286131 |
0.82 |
C12(C)CCC3C(CCC4CC(O)CCC34C)C1CC(C)C2(O)C(C)=O |
|
MCULE-9557132280 |
0.82 |
C12(C)CCC(CC1C(=O)CC1C3C(C)(C(CC3)C(C)CCCC(C)C)CCC12)O |
|
MCULE-1785493425 |
0.82 |
C(C(O)C1CC1)C(O)=O |
|
MCULE-4180377229 |
0.82 |
C[C@@]1([C@H](C2(C=O)CC2)CCCC1)O |
|
MCULE-4513523452 |
0.82 |
C12CC3CC(CC(C3)C1O)C2=O |
|
MCULE-4815351354 |
0.82 |
[C@]12(C)CC[C@]3([C@@]([H])(CC[C@@]4([H])C[C@H](O)CC[C@]34C)[C@]1([H])C[C@@H](C)[C@]2(O)C(C)=O)[H] |
|
MCULE-5519958446 |
0.82 |
OC1C(C(O)=O)CCC1 |
|
MCULE-6540318880 |
0.82 |
C(CC(CCC)CC(=O)O)(=O)O |
|
MCULE-4182736072 |
0.82 |
CC1(C(C2(C=O)CCC2)CCCC1)O |
|
MCULE-5143114271 |
0.82 |
[H]C12CC(O)CCC1(C)C1C(CC3(C)C(O)CCC3C1CC2)=O |
|
MCULE-7888882967 |
0.82 |
O=C(CC(CC(=O)O)CC(C)C)O |
|
MCULE-3513138919 |
0.82 |
O=C1CCC2(C)C3CC(O)C4(C)C(CCC4C3CCC2C1)C(C)=O |
|
MCULE-4575533706 |
0.82 |
C(=O)(CCCC)C([O-])=O.[Na+] |
|
MCULE-4685004246 |
0.82 |
O=C1CC2C3CCC(C(C)CCCC(C)C)C3(C)CCC2C2(C)CCCCC21O |
|
MCULE-9421331312 |
0.82 |
CC(C(C1(C(O)=O)CC(C)C1)C)O |
|
MCULE-5537226560 |
0.82 |
C[C@@]1([C@H](CC(C2CC2)=O)CCCC1)O |
|
MCULE-4288241316 |
0.82 |
CC(CC1(C(O)=O)CC(C)C1)O |
|
MCULE-2280230224 |
0.82 |
C12(CCCCC1CC1C(=O)C2CCC1)O |
|
MCULE-3700635492 |
0.82 |
OC1(CCC2(CC2)CC1)CC=O |
|
MCULE-3783153228 |
0.82 |
OC1(CCC2(CC2)CC1)CCC=O |
|
MCULE-4660106838 |
0.82 |
CC1(C(CC(C2CC2)=O)CCCC1)O |
|
MCULE-9500236289 |
0.82 |
O=C(O)C1CCCC1=O |
|
MCULE-8654161103 |
0.82 |
C1(C(O)=O)CC(=O)C1(C)C |
|
MCULE-4467363537 |
0.82 |
C1(CO)(C(C)CC1)C(O)=O |
|
MCULE-9173713717 |
0.82 |
[C@]12(C)CCC(C[C@]1([H])C(=O)CC1C3[C@@](C)([C@@](CC3)(C)O)CCC12)=O |
|
MCULE-8869632251 |
0.82 |
[C@]12([H])[C@@](O)(C)C(C[C@]([H])(C1)C2(C)C)=O |
|
MCULE-3680158952 |
0.82 |
C(O)(=O)C(C1CCC1)=O |
|
MCULE-2843513529 |
0.82 |
C(C(=O)O)C(=O)C1CC1 |
|
MCULE-4650460311 |
0.82 |
O=C1CC2C3CCCC3(C)CCC2C2(C)CCCCC21O |
|
MCULE-7242119099 |
0.82 |
CC1(C(C2(C=O)CC2)CCCC1)O |
|
MCULE-8464659306 |
0.82 |
C[C@]12CC[C@H](O)C[C@]1([H])[C@@H](O)C[C@@]1([H])[C@]3([H])CC[C@H](C(=O)C)[C@@]3(C)CC[C@]21[H] |
|
MCULE-8520903082 |
0.82 |
OC([C@H]1C[C@H](C(O)=O)C1)(C)C |
|
MCULE-7740494752 |
0.82 |
CC(CC1(C(O)=O)CCC1)=O |
|
MCULE-5236898540 |
0.82 |
C1(CC(C1)CC(O)=O)=O |
|
MCULE-2640984044 |
0.82 |
[C@@]12(C)[C@@H](C(C)=O)CCC1[C@]1(C([C@H](O)C2)[C@@]2(C)CCC(C[C@]2(CC1)[H])=O)[H] |
|
MCULE-4697861595 |
0.82 |
C(C1(CCC1)O)C(O)=O |
|
MCULE-6213617617 |
0.82 |
[C@@]12(C)[C@@]([H])([C@H](C)O)CCC1[C@]1(C([C@@]3(C)CC[C@H](C[C@]3(CC1)[H])O)C(=O)C2)[H] |
|
MCULE-6845034407 |
0.82 |
C1CC(O)(CCO)CCC1=O |
|
MCULE-4135920946 |
0.82 |
C[C@@]1([C@H](C2(C=O)CCCC2)CCCC1)O |
|
MCULE-6757554121 |
0.82 |
O=C1CC2(C)C3CCC4(C)C(O)CCC4C3C(CC2(CC1)[H])=O |
|
MCULE-8418088728 |
0.82 |
OC1(C2(CCCC2)CC1)CCC=O |
|
MCULE-9704365799 |
0.82 |
[H]C12CC(O)CCC1(C)C1C(CC3(C)CC(O)CC3C1CC2)=O |
|
MCULE-8508145982 |
0.82 |
O=C1CCC2(C)C3C(CC4(C)CC(O)CC4C3CCC2(C1)[H])=O |
|
MCULE-3249043153 |
0.82 |
[H]C12CC(O)CCC1(C)C1CCC3(C)CC(O)CC3C1C(C2)=O |
|
MCULE-9128202618 |
0.82 |
OC1(C2(CCCC2)CC1)CC=O |
|
MCULE-2942441696 |
0.82 |
[H]C12CC(O)CCC1(C)C1CCC3(C)CC(O)CC3C1CC2=O |
|