SANC00921 β-Phellandrene




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MolPort-039-338-496 1 COc1ccc(cc1OC)[C@]12CCN(C)C1CC(=O)C=C2
MolPort-039-338-496 1 COc1ccc(cc1OC)[C@]12CCN(C)C1CC(=O)C=C2
MCULE-1851405136 0.88 C1(CC/C=C(\C)/C)CC(C)(C)CC(=C)C=1
MCULE-4260125231 0.85 C1C(=C)CCC=C(C)CC[C@@H](C(C)C)C=1
MCULE-6946131615 0.82 C12C=CCCC1(C)C1CCC3(C)C(C(C)CCCC(C)C)CCC3C1CC=2
MCULE-8119650659 0.81 C12([H])CC1([H])C=CC(=C)CC2
MCULE-3292573526 0.81 C12(CCC1([H])C=CC(=C)CC2)[H]
MCULE-5064867721 0.81 C12C(C)(C)C(C1)CC=CC2=C
MCULE-1666536703 0.79 C[C@@H](C=C[C@H]([C@@H]1[C@]2(C)C(=C3[C@@](CC2)([H])[C@]2(C)[C@@]4([C@H](CC2)C4)C=C3)CC1)C)C(C)C
MCULE-1150484669 0.79 C1C(C)(C)C(/C=C/C(/C)=C/C=C/C(/C)=C/C=C\C=C(\C)/C=C/C=C(\C)/C=C/C2=C(C)CCCC2(C)C)=C(C)CC1
MCULE-2013298810 0.79 C1(C(C)(C)CCCC=1C)C=CC(C)=CC=CC(C)=CC=CC=C(C)C=CC=C(C)C=CC1C(C)(C)CCCC=1C
MCULE-3019762823 0.79 CC1(C(/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C2C(C)(C)CCCC=2C)\C)\C)/C)/C)=C(C)CCC1)C
MolPort-019-937-405 0.79 COc1ccc(cc1OC)C12CCN(C)C1=CC(=O)CC2
MolPort-019-937-405 0.79 COc1ccc(cc1OC)C12CCN(C)C1=CC(=O)CC2
MCULE-5783445973 0.78 C1CCC(C)=CC(C)=C1
MCULE-5756833407 0.76 [C@]12(C)[C@H](C)CCC=C1CC[C@@H](C(=C)C)C2
MCULE-5616785989 0.76 C12(C)C(C)CCC=C1CCC(C(C)=C)C2
MCULE-6821761650 0.75 C1CC2C=C(C3C4CCC5CCC(C=3)C54[H])C3CCC1C23[H]
MCULE-6864358337 0.75 C1C(C(C)C)=CCC(C(C)C)C1
MCULE-9605328516 0.75 C(CC)(C)(C)C1CC=CCC1
MCULE-8565634937 0.75 C(=CCC(C)CC/C=C(\C)/C)C=C
MCULE-8763605616 0.75 CCCCCC=CC=C
MolPort-042-558-565 0.74 COc1ccc(cc1OC)C1(CCCC1)C(=O)N[C@@H]1CC=CC[C@H]1C(N)=O
MolPort-002-578-598 0.74 COc1ccc(CCN2C(=O)C3C(C(C=CC3c3ccccc3)c3ccccc3)C2=O)cc1OC
MolPort-042-558-565 0.74 COc1ccc(cc1OC)C1(CCCC1)C(=O)N[C@@H]1CC=CC[C@H]1C(N)=O
MCULE-2462317444 0.73 C(C)(=C)C1CCC(=CC1)C
MCULE-8485688872 0.73 [H]C12C(C)(CC=CC1)C1(CCC3(C)C(C(C)C=CC(C)C(C)C)CCC3C1=CC2)[H]
MCULE-9374013475 0.73 CCCCCCC=C/C=C(\C)/C
MCULE-4024786417 0.73 [H]C12C(C)(CC=CC1)C1(CCC3(C)C(C(C)CCC(C)C(C)C)CCC3C1=CC2)[H]
MCULE-6736529827 0.73 C=C(C)[C@H]1CCC(C)=CC1
MCULE-1385130554 0.73 C1C[C@H](C(=C)C)CCC=1C
MCULE-5992544838 0.73 C1(C)CC[C@H](C(C)=C)CC=1
MCULE-7380592285 0.73 C(C)(=C)[C@@H]1CCC(=CC1)C
MCULE-6038724907 0.72 CC1([C@@]2(C[C@]1(CC=C2C)[H])[H])C
MCULE-4741815186 0.72 [C@H]12C(C)=CC[C@H](C1(C)C)C2
MCULE-3589656574 0.72 C12C(C)=CCC(C1(C)C)C2
MCULE-7493190737 0.72 C1CCC2CCC3CCCC4C3=C2C1CC4
MCULE-2562452387 0.72 [H]C12C(C)(C)C=CCC1(C)C1CC=C3C4(CC(C)(C)CCC4(C)CCC3(C)C1(C)CC2)[H]
MCULE-5575647926 0.72 C(C1CCCCCCC=1)C1CC=CC1
MCULE-3867013572 0.72 [C@H]12C(C)=CC[C@H](C1(C)C)C2
MCULE-7809911769 0.71 C1CCCCCCCCCCC=1
MCULE-1230321976 0.71 C1CCCCCC=CC1
MCULE-8207675419 0.71 C(=CCCCCCCC)CCCCCCCC
MCULE-1585960766 0.71 C(=CCCCCCCCCCCCCCCCC)(CCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC
MCULE-9704495201 0.71 C1CCCCCCC=1
MCULE-2737650784 0.71 C1=CC(=C)C=CCCCC1
MCULE-8332309727 0.71 C1(C)(C)CC(C)(C)CC=C1
MCULE-1793283479 0.71 C1CCCCCCCCC=1
MCULE-8462090063 0.71 C1CC(C)=CCCCC=CC1
MCULE-6643575770 0.71 C(CCCCCCCCCCCCCCCC)=CCCCCCCCCCCCCCCCCC
MCULE-7932096825 0.71 C12C=CC=CC(C1)CCC2
MCULE-7705781017 0.71 C1C=CCC(C(C)(C)C)C1
MolPort-003-181-326 0.71 COc1ccc(CC(C)NCCC2=CCCCC2)cc1OC
MCULE-6084404864 0.70 C1C2([H])CC2([H])C=CC=CC1
MCULE-5702073198 0.70 C/C(=C/C=CC1CCCCC1)/C
MolPort-042-608-527 0.70 COc1ccc(CC(C)NC(=O)C2CC3CC2C=C3)cc1OC
MolPort-005-002-300 0.70 COc1ccc(CC2(CCC(=O)NCC3CC4C=CC3C43CC3)CCC(=O)N2)cc1OC
MolPort-042-608-527 0.70 COc1ccc(CC(C)NC(=O)C2CC3CC2C=C3)cc1OC
MCULE-5051897823 0.69 C12C(C)(C)CCCC1(C)C1CCC3(C)CCCC3C1CC=2
MCULE-5503440064 0.69 [H]C12C(C)(C)CC=CC1(C)C1CCC3(C4(C(C(C)C)CCC4(C)CCC3(C)C1(C)CC2)[H])[H]
MCULE-6271009692 0.69 C(C1CCCCCC=1)C1CC=CC1
MCULE-8864677718 0.69 C12(C(C1)CCC=C2C)C
MCULE-4588166214 0.69 [H]C12CCC=CC1(C)C1CCC3(C)CCCC3C1CC2
MCULE-3644985415 0.69 [H]C12CCCC1(C)C1CC=C3C4(C(C)C(C)CCC4(C)CCC3(C)C1(C)CC2)[H]
MCULE-8214516455 0.69 C12CCCCC1(C)C1CCC3(C)C(C(C)CCCC(C)C)CCC3C1CC=2
MCULE-9345089020 0.69 C1CC2C(C)(C)C3C(C)=CCC2(C3)C1C
MCULE-7880343136 0.69 C1CC(C2CCCC=C2)C=CC1
MCULE-4061101233 0.69 C1CC(C)=C2CCC(C)=CCCC(=C)CCC1C2(C)C
MCULE-2811504753 0.69 C1C2C(C)(C)C2CC=C1C
MCULE-7795984748 0.69 CCCCCC=C/C=C(\C)/C
MCULE-1070537748 0.69 [H]C12CCCC1(C)C1(CCC3(C)C(C(C)C=CC(C)C(C)C)CCC3C1=CC2)[H]
MCULE-8327062145 0.69 [C@@]123[C@H](C)CC[C@@]1([H])C([C@H](C(C)=CC2)C3)(C)C
MCULE-7201475262 0.69 C12C(C1CC=CC2)(C)[H]
MCULE-8068904503 0.69 C12CCCC31CC(C=C3)C2
MCULE-1265880444 0.69 C12CC31CCCCCCCCCCCCC(=CC3)C2
MCULE-7038834056 0.69 C1CC2CC2CC=1
MCULE-4790521220 0.69 C1CC2C(C)(C)C2CC=1
MCULE-3170768327 0.69 C1CC2(C)CC2(C)CC=1
MolPort-019-937-428 0.69 COc1ccc(cc1OC)[C@]12CCN(C)[C@H]1CC(=O)CC2
MolPort-039-338-557 0.69 COc1ccc(cc1OC)[C@]12CCN(C)C1CC(=O)CC2
MolPort-019-937-428 0.69 COc1ccc(cc1OC)[C@]12CCN(C)[C@H]1CC(=O)CC2
MolPort-039-338-557 0.69 COc1ccc(cc1OC)[C@]12CCN(C)C1CC(=O)CC2
MCULE-1604265119 0.68 C12C(C)(C)C(C1)C=CC=C2
MCULE-8350979001 0.68 C1C2(CC2)CC=CC1
MCULE-8120653180 0.68 C1(CC)(CC)C2C(C3CC2C=C3)C=C1
MCULE-8052625701 0.68 C1CC2CC2CCC=C1
MCULE-9355268312 0.68 C12C=C(CC1C1CC2C(=C1)C)C
MCULE-2787902394 0.68 C=CC1C2C=CC(C2)C1
MCULE-6193286520 0.68 CC1C=CC2C1C1C=CC2C1
MCULE-4997792867 0.68 C1(CCCCC1)C=CC1CCCCC1
MCULE-5201834756 0.68 C1C2C=CC(C2)C1
MCULE-5623444215 0.68 C1(C2C=CC(C34C=CC23CC=CC4)C1C)C
MCULE-6619141408 0.68 C1CC2CC(=C3CC4CCC5CCC3C54[H])C3CCC1C23[H]
MCULE-4514853156 0.68 C1CCC=CCC1
MCULE-7424334706 0.68 C1=CC2C3C(C)=C(C)C3C1CC2
MCULE-1540616337 0.68 O=C1CCC2C1(C)CCC1C2CC=C2C=CCCC21C
MolPort-005-108-911 0.68 CC1(C)[C@@H]2C[C@H]1C(CCNC(=O)CCC1(Cc3ccc4OCOc4c3)CCC(=O)N1)=CC2
MCULE-5237148453 0.68 C1=CC2C3C=CC3C1C(C)C2C
MCULE-6452451064 0.68 C1(C)C2CC2(C)C=C(C)C=C(C)C=1
MCULE-3415595752 0.68 C1(C)C2(C(C)(C3(C)C(C)=C(C)C23C)C=1C)C
MCULE-9069962871 0.68 C12C=CCC1C1CC2C=C1
MolPort-006-392-578 0.67 COc1ccc(cc1)C(CN(C)C)C1=CCCCC1
MCULE-2740140034 0.67 CCCCCC=CC(C)(C)C
MCULE-3233444254 0.67 C(/C)(\C)=C/CCC(C)CC=CCC
MCULE-8312535251 0.67 C1C(CC)C=CC1
MCULE-6675505799 0.67 CCC=CCCCCC=CCC
MCULE-3621740975 0.67 CCCCCC=CC(C)C
MCULE-9302425722 0.67 C1(CCCCC=1C)C
MCULE-5809713750 0.67 [C@@H]1(O)C(=C)CC[C@@H](C(C)C)C=CC(=C)CC1
MCULE-7470328938 0.67 C1CC2CC=CC2CC=1
MCULE-6598443660 0.67 C12C=C3C(C4CCC3(C)C(C4)(C)C)C=1C1CCC2(C)C1(C)C
MCULE-9491766453 0.67 C1CC(C)(C)C(C)(C)CC=1
MCULE-6343106785 0.67 C1C(C)CC=CC1
MolPort-000-684-664 0.66 COc1ccc(CCN2C(=O)C3CC(C)=C(C)CC3C2=O)cc1OC
MolPort-001-993-435 0.66 COc1ccc(CCN2C(=O)C3CC=C(C)CC3C2=O)cc1OC
MolPort-006-374-410 0.66 COc1ccc(CCC(=O)NCCC2=CCCCC2)cc1OC
MolPort-001-886-660 0.66 COc1ccc(CCN2C(=O)C3C4CC(C=C4)C3C2=O)cc1OC
MolPort-042-665-749 0.66 Cl.COc1ccc(cc1)C(CN(C)C)C1=CCCCC1
MolPort-002-938-998 0.66 COc1ccc(CCNC(=O)CCC(=O)NCCC2=CCCCC2)cc1OC
MolPort-000-719-135 0.66 COc1ccc(CCN2C(=O)C3C4C=CC(C3C2=O)C42CC2)cc1OC
MolPort-042-665-749 0.66 Cl.COc1ccc(cc1)C(CN(C)C)C1=CCCCC1
MCULE-9990082723 0.66 O=C1C(C)(C)C(=C)C(C)=C(C)C1(C)C
MCULE-1586115128 0.66 C1C2C3C(CC=CC23)C=1
MCULE-6947636935 0.66 C1(=CC=C(C2CCCCC2)CC1)C1CCCCC1
MCULE-1662175214 0.66 C12C=CC3C=CC(C13)C(C=C)=C2
MCULE-1565327857 0.66 C1C2(C3C4C5(CC5)C(C3C=C2)C=C4)C1
MolPort-039-316-567 0.65 COc1ccc(CCC(=O)NC2CCC=CC2)cc1OC
MolPort-028-311-185 0.65 COc1cc(OC)cc(c1)C1CCN(C1)C(=O)C1CCC=CC1
MolPort-039-316-567 0.65 COc1ccc(CCC(=O)NC2CCC=CC2)cc1OC
MolPort-002-013-443 0.65 COc1ccc(CCN2C(=O)C3C(C4C=CC3C3CC43)C2=O)cc1OC
MolPort-000-756-988 0.65 COc1ccc(CCN2C(=O)C3C(C4C=CC3C3C4C(=O)N(CCc4ccc(OC)c(OC)c4)C3=O)C2=O)cc1OC
MolPort-000-748-113 0.65 CCC12C3C(C(C4C1C(=O)N(CCc1ccc(OC)c(OC)c1)C4=O)C(=C2c1ccccc1)c1ccccc1)C(=O)N(CCc1ccc(OC)c(OC)c1)C3=O
MolPort-035-824-874 0.65 O=C(C1CCC=CC1)N1CCC(C1)c1ccc2OCOc2c1
MolPort-028-311-185 0.65 COc1cc(OC)cc(c1)C1CCN(C1)C(=O)C1CCC=CC1
MolPort-009-363-661 0.65 COc1ccc(CCNC(=O)CC2CCC=C2)cc1OC
MolPort-009-489-962 0.65 COc1ccc(CCNC(=O)C2CCC=CC2)cc1OC
MolPort-035-824-874 0.65 O=C(C1CCC=CC1)N1CCC(C1)c1ccc2OCOc2c1
MCULE-3292738983 0.65 C12(C)CCC(C(C)C)=C1CCC(C)CC2
MCULE-5383443260 0.65 O=C/C=C(/C=C/C=C(/C=C/C1C(C)(C)CCCC=1C)\C)\C
MCULE-1027409234 0.65 C(C1CCC=CC1)=C
MCULE-3359375571 0.65 CCC(CC)C=CC=C
MCULE-1539700449 0.65 C1(C=CC(C)=CC=CC(C)=CC=O)=C(C)CCCC1(C)C
MCULE-8044728821 0.65 C12C(C)=CC1C1C=CC2C=CC=C1
MCULE-3193644109 0.65 C1=CC2C=C(C3C4C=CC5C=CC(C=3)C54[H])C3C=CC1C23[H]
MCULE-5926246821 0.65 C1(CCC=CC1)C=CC1CCC=CC1
MCULE-2815659183 0.65 C1(CCC(C)=CC=CC(C)=O)C(C)(C)CCCC=1C
MCULE-6524977881 0.65 C1(C(C)(C)CCCC=1C)C=CC(C)=CC=CC(C)=CCO
MCULE-5135553681 0.65 C1(C(C)(C)CCCC=1C)/C=C/C(C)=O
MCULE-3537216178 0.65 C=CCCC1CCCCCCC=1
MCULE-4951251283 0.65 C1(C(C)(C)CCCC=1C)/C=C/C(/C)=C/C=C/C(/C)=C/CO
MCULE-8520270175 0.65 C12([H])C=CC3([H])CCC([H])(CC1)C23[H]
MCULE-7587888866 0.65 C1(C(C)(C)CCCC=1C)C=CC(C)O
MCULE-3564016252 0.65 C1CC=CCC1
MCULE-5334604577 0.65 C12(C)CCCC31C(C)CCC3(C)C(C)=C2
MCULE-1740726456 0.65 C/C(/C)=C/CCC1CCCCCCC=1
MCULE-3023312584 0.65 C1C=CC(C2C=CCCCCC2)CCCC1
MCULE-3640052920 0.65 C1(C(C)(C)CCCC=1C)C=CC(C)=O
MCULE-9858142669 0.65 CC(=O)/C=C/C=C(\C)/C=C/C1C(C)(C)CCCC=1C
MolPort-000-757-275 0.64 COc1ccc(CCN2C3=C(C(C4=C2CC(C)(C)CC4=O)c2ccc(OC)c(OC)c2)C(=O)CC(C)(C)C3)cc1OC
MolPort-046-770-647 0.64 COc1ccc(CC(=O)N2C3CCC2CC(C3)=CC2CC2)cc1OC
MolPort-030-077-080 0.64 COc1ccc(cc1)C1CCCCN(C1)C(=O)C1CC2CC1C=C2
MolPort-005-038-476 0.64 COc1cc(CC2(CCC(=O)NCCC3=CC[C@H]4C[C@@H]3C4(C)C)CCC(=O)N2)ccc1F
MolPort-002-725-003 0.64 COc1cccc(c1)C1CC(=O)C=C(C1)NCCc1ccc(OC)c(OC)c1
MolPort-001-533-879 0.64 COc1ccc(CCN2C(=O)C3C4CCC(C3C2=O)C4=C(C)C)cc1OC
MolPort-046-696-856 0.64 COc1ccc(CC(=O)N2C3CCC2CC(C3)=C2CCC2)cc1OC
MolPort-046-770-527 0.64 COc1ccc(CC(=O)N2C3CCC2CC(C3)=C2CC2)cc1OC
MolPort-002-509-698 0.64 COc1ccc(cc1OC)C1CC(=O)N(C)C2=C1C(=O)CC(C)(C)C2
MolPort-002-806-708 0.64 COc1cccc(c1)C1CC2N(Cc3ccccc3)C1C=CC2=O
MolPort-001-900-956 0.64 COc1ccc(CCNC2=CC(=O)CC(C2)c2ccccc2)cc1OC
MolPort-020-124-245 0.64 COc1cc2CCN(CCc2cc1OC)C(=O)C1CCC=CC1
MolPort-004-955-153 0.64 COC1=CC2C3Cc4ccc(OC)c(O)c4C2(CCN3C)CC1=O
MolPort-002-507-299 0.64 COC1=C[C@@H]2[C@@H]3Cc4ccc(OC)c(O)c4[C@]2(CCN3C)CC1=O
MolPort-004-996-772 0.64 COc1cccc(CC(C2CCN(CC2)C(=O)C2CCC=CC2)N(C)C(=O)CC(C)C)c1
MolPort-002-717-811 0.64 COc1ccc(CCNC2=C(C(=O)Cc3ccccc3)C(=O)CC(C)(C)C2)cc1OC
MolPort-030-077-080 0.64 COc1ccc(cc1)C1CCCCN(C1)C(=O)C1CC2CC1C=C2
MolPort-046-770-527 0.64 COc1ccc(CC(=O)N2C3CCC2CC(C3)=C2CC2)cc1OC
MolPort-046-696-856 0.64 COc1ccc(CC(=O)N2C3CCC2CC(C3)=C2CCC2)cc1OC
MolPort-020-124-245 0.64 COc1cc2CCN(CCc2cc1OC)C(=O)C1CCC=CC1
MolPort-046-770-647 0.64 COc1ccc(CC(=O)N2C3CCC2CC(C3)=CC2CC2)cc1OC
MCULE-2501481360 0.64 C12(C)CCCC(C)(N)C1CC=C1C=C(C(C)C)CCC12
MCULE-8597939572 0.64 C1(/CC(C)(C)CC(C)=C/1)=C(\C#N)/C#N
MCULE-3282836543 0.64 C1(/CCCCC/1)=C1\CCCCC\1
MCULE-9947050551 0.64 C(=CC=CC=C)CCCCC
MCULE-3095136217 0.64 C1C(C)(C)CC(=C)C2(C)CC2C=1
MolPort-000-766-275 0.63 [Cl-].COC1=CC2[C@@H]3Cc4ccc(OC)c(O)c4C2(CC[NH+]3C)CC1=O
MolPort-002-723-186 0.63 CCOc1ccc(CCN2C(=O)C3C4CC(C=C4)C3C2=O)cc1OCC
MolPort-002-536-788 0.63 COc1ccc(cc1OC)C1C2=C(CC(C)(C)CC2=O)N(CCc2ccccc2)C2=C1C(=O)CC(C)(C)C2
MolPort-001-897-363 0.63 COc1ccc(CCNC(=O)C2C3CC\C=C\CC\C=C/CCC23)cc1OC
MolPort-000-912-833 0.63 COc1ccc(cc1OC)C1CC(=O)NC2=C1C(=O)CC(C)(C)C2
MCULE-9720211636 0.63 [C@@]12([H])CCC(C)=CCCC(=C)[C@@]1([H])CC2(C)C
MolPort-000-912-594 0.63 COc1ccc(cc1OC)C1CC(=O)NC2=C1C(=O)CCC2
MCULE-9138915695 0.63 C12C3CC(C=C3)C1C=C2C
MolPort-023-276-955 0.63 Cl.COC1=C[C@@H]2C3Cc4ccc(OC)c(O)c4[C@@]2(CCN3C)CC1=O
MCULE-2718905302 0.63 C/C(/C)=C/CCC1CCCCCC=1
MolPort-019-949-554 0.63 Cl.COC1=C[C@@H]2C3Cc4ccc(OC)c(O)c4[C@]2(CCN3C)CC1=O
MCULE-3106478848 0.63 [C@@]12([H])CCC(C)=CCCC(=C)[C@@]1([H])CC2(C)C
MolPort-020-189-177 0.63 COc1cc(CC(=O)N2C[C@H]3CC=C(C)C[C@H]3C2)cc(OC)c1OC
MCULE-9087397344 0.63 C1(C(C)(C)C)C2([H])CCCC2([H])C=1
MolPort-044-561-319 0.63 Cl.COC1=C[C@@H]2[C@H]3Cc4ccc(OC)c(O)c4[C@]2(CCN3C)CC1=O
MCULE-4374054066 0.63 C12C(CCC=C(C)CCC1C(C)(C)C2)=C
MolPort-002-904-677 0.63 Cl.COC1=C[C@@H]2[C@@H]3Cc4ccc(OC)c(O)c4[C@]2(CCN3C)CC1=O
MCULE-4227190152 0.63 C1(C(C)C)C2([H])CCCC2([H])C=1
MolPort-016-585-778 0.63 Cl.COc1ccc(CCC(C)NCCC2=CCCCC2)cc1
MCULE-8444624529 0.63 C12C=CC1(C)CCC2C
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