SANC01072 Exocarpic acid



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Analog ID Similarity score SMILES

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MCULE-2116135210 1 C(=CC(C)(C)CC(C)(C)C)(C)C
MCULE-5254978900 1 C(=CC(C)CCC)C
MolPort-003-935-672 1 CCCC\C=C\C
MCULE-4645711274 0.93 C=CC(CC/C=C(\C)/C)C
MCULE-4117888672 0.87 CCC(C)=CC(C)CC(C)C
MolPort-003-925-918 0.87 CCCCC\C=C\C
MCULE-1124953373 0.87 C/C(/C)=C/CC1CC=CC1
MCULE-7970794651 0.87 C(C(=C)C)CC=CC
MCULE-5331822937 0.81 CC(CC1CC=CC1)(C)C
MCULE-6595813039 0.81 C(C)CC=CCCCC=CCCC
MCULE-6446802470 0.81 C/C(/C)=C\CC[C@H](C)CCCC
MCULE-2613510349 0.81 C/C(/C)=C/CCC1CC1
MCULE-4910794167 0.81 C1CC/C(=C(\C)/C)/CCCC1
MCULE-1797171190 0.81 C1CCC(/C=C(\C)/C)CCCCCCCC1
MCULE-6684474364 0.81 CC(CC1CC=CC1)C
MolPort-003-925-898 0.77 CCC\C=C\C
MCULE-2110588796 0.77 C(=C/CCC)(\C)/C
MolPort-023-331-697 0.76 CCC[C@H]1CC[C@@H](CC1)[C@H]1CC[C@@H](CC1)\C=C\C
MolPort-001-766-377 0.76 CC=C1C2CC3CC(C2)CC1C3
MolPort-001-785-792 0.76 CC(C)=CCC\C(C)=C\CC\C(C)=C\CC\C=C(/C)CC\C=C(/C)CCC=C(C)C
MolPort-002-501-977 0.76 CC1CCC=CC1
MolPort-001-770-056 0.76 CC1=CCCCC1
MolPort-001-792-515 0.76 CC(C)=CCCC(=C)C=C
MolPort-006-395-270 0.76 [2H]C([2H])([2H])C(=CCCC(=C)C=C)C([2H])([2H])[2H]
MolPort-008-154-491 0.76 C\C=C\C12CC3CC(CC(C3)C1)C2
MolPort-035-681-340 0.76 CC1(C)CCC=CC1
MCULE-4319451116 0.76 C1(C)CCC=C(C)CCC=C(C)CCC=1
MolPort-044-723-758 0.76 CCC[C@H]1CC[C@@H](CC1)[C@H]1CC[C@@H](CC1)C=CC
MCULE-4236330435 0.76 C1(C)(CC/C=C(\C)/C)CC(C)(C)CCC1
MolPort-046-684-541 0.76 C\C=C\C1CCCCC1
MCULE-9648779204 0.76 CC1CC(CC/C=C(\C)/C)CCC1
MolPort-046-761-933 0.76 [2H]C([2H])([2H])C(=CCC\C(C)=C\CC\C(C)=C\CC\C=C(/C)CC\C=C(/C)CCC=C(C)C)C([2H])([2H])[2H]
MCULE-2740140034 0.76 CCCCCC=CC(C)(C)C
MCULE-7233625152 0.76 CC1=CCCC(C)=CCC1
MCULE-7235150219 0.76 CC1C(C)CC(CC/C=C(\C)/C)CC1
MCULE-1565918521 0.76 C(C)(CC/C=C(\C)/C)=CCCC(C)=CCCC=C(C)CCC=C(C)CC/C=C(\C)/C
MCULE-6502298535 0.76 C(/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/C)C/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/C
MCULE-5453347985 0.76 CC1CCC(CC/C=C(\C)/C)CC1
MCULE-2586633782 0.76 CC1CC(CC/C=C(\C)/C)CC(C)C1
MCULE-3936525776 0.76 C/C(/C)=C/CCC1CCCC1
MCULE-3233444254 0.76 C(/C)(\C)=C/CCC(C)CC=CCC
MCULE-5344153967 0.76 C/C(/C)=C/CCC1CCC1
MCULE-4493898127 0.76 CCC[C@@H]1CC[C@@H]([C@@H]2CC[C@@H](/C=C/C)CC2)CC1
MCULE-6343106785 0.76 C1C(C)CC=CC1
MCULE-1881125601 0.76 C(C)(C)(C)C1CC/C(/CC1)=C(/C)\C
MCULE-4811265406 0.76 C12(CC3CC(CC(C3)C1)C2)C=CC
MCULE-9302425722 0.76 C1(CCCCC=1C)C
MCULE-2470398758 0.76 CC(CC1CC=CC1)=C
MCULE-3621740975 0.76 CCCCCC=CC(C)C
MCULE-9906398840 0.76 CC(C(CC1CC=CC1)C)C
MCULE-6675505799 0.76 CCC=CCCCCC=CCC
MCULE-4539359338 0.76 C1(C)(C)C(C)CC=C1C
MCULE-7175243615 0.76 CC(CCC1CC=CC1)C
MCULE-9491766453 0.76 C1CC(C)(C)C(C)(C)CC=1
MolPort-001-779-794 0.75 C1CCC=CC1
MCULE-3564016252 0.75 C1CC=CCC1
MolPort-001-785-797 0.73 CC1=CCCC1
MCULE-8508688474 0.73 C1(CCCC=1)C
MCULE-9916620076 0.73 C1(C)(C)C=CC(C)(C)C1
MolPort-002-507-709 0.72 C1CCCCC\C=C\CCCC1
MolPort-020-180-049 0.72 CC(C)(C)C1CCC=CC1
MolPort-001-787-073 0.72 C1CCC\C=C/CC1
MolPort-001-770-064 0.72 CCCCCCCCCCCCC\C=C\CCCCCCCC
MolPort-003-929-253 0.72 C1CCCCC\C=C/CCCC1
MolPort-000-006-321 0.72 CCCCCCCCCCCCC\C=C/CCCCCCCC
MCULE-7809911769 0.72 C1CCCCCCCCCCC=1
MCULE-1312392396 0.72 CC1CCC(CC2CC=CC2)CC1
MCULE-6884931397 0.72 CCC(C/C=C(\C)/C)(N)C
MCULE-1585960766 0.72 C(=CCCCCCCCCCCCCCCCC)(CCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC
MCULE-6552207667 0.72 CC1CC(CC2CC=CC2)CCC1
MCULE-3391259052 0.72 C(C1CC=CC1)CC1CCCCC1
MCULE-6219303713 0.72 CC1C(C)CC(CC2CC=CC2)CC1
MCULE-9704495201 0.72 C1CCCCCCC=1
MCULE-7766332860 0.72 CC1CC(CCC2CC=CC2)CCC1
MCULE-7662726220 0.72 CCC1CC(CC2CC=CC2)CCC1
MCULE-8462090063 0.72 C1CC(C)=CCCCC=CC1
MCULE-5232057577 0.72 C(C1CC=CC1)C1CCC1
MCULE-2168474625 0.72 CC(C(C/C=C(\C)/C)N)C
MCULE-2453519056 0.72 CC1CCC(CCC2CC=CC2)CC1
MCULE-8332309727 0.72 C1(C)(C)CC(C)(C)CC=C1
MCULE-8262083453 0.72 CCC1C(CC2CC=CC2)CCCC1
MCULE-5235454213 0.72 CCC1CCC(CC2CC=CC2)CC1
MCULE-3282836543 0.72 C1(/CCCCC/1)=C1\CCCCC\1
MCULE-6341482217 0.72 C(C1CC=CC1)C1CC1
MCULE-7604284309 0.72 CCC(CC=CC)(N)C
MCULE-2522930591 0.72 C(C1CCCC1)CC1CC=CC1
MCULE-2167933962 0.72 C(C1CCCCCC1)C1CC=CC1
MCULE-1230321976 0.72 C1CCCCCC=CC1
MCULE-2563386017 0.72 C1(C)=CCCC(C)=CCCC=C(C)CC1
MCULE-6643575770 0.72 C(CCCCCCCCCCCCCCCC)=CCCCCCCCCCCCCCCCCC
MCULE-8207675419 0.72 C(=CCCCCCCC)CCCCCCCC
MCULE-2241412031 0.72 CC1(CCCC1)CCC1CC=CC1
MCULE-6731958790 0.72 C(F)(C=CCCCC)(F)F
MCULE-1255809850 0.72 C(C1CCCCC1)C1CC=CC1
MCULE-7705781017 0.72 C1C=CCC(C(C)(C)C)C1
MCULE-1793283479 0.72 C1CCCCCCCCC=1
MCULE-2862470405 0.72 CC1CC(CC2CC=CC2)CC(C)C1
MCULE-3725404239 0.72 CC=C1C(C)(C)C2CC1CC2
MCULE-7380883171 0.72 C/C(/C)=C/CCC1C2CC(CC2)C1
MCULE-4110985472 0.72 C(C1CC=CC1)C1CCCC1
MolPort-001-759-289 0.71 C1CC=CC1
MCULE-8785635218 0.71 C1CCCC=1
MolPort-033-481-638 0.69 CCC(CC)CC=C
MolPort-046-792-787 0.69 [2H]C([2H])([2H])CCCC=C
MolPort-006-112-368 0.69 CC1=C(C)CCC1
MCULE-5609717261 0.69 C/C=C(\CC)/CC
MCULE-4750698031 0.69 C(CCC)C=C
MCULE-1717336447 0.69 C(CC(C)(CC)CC)=C
MCULE-7756364310 0.69 C=CC(CC(C)(C)C)C
MCULE-2692803387 0.69 CCCC(C)C=C
MCULE-8885290229 0.68 C(C1CC=CC1)CC1C2CC(CC2)C1
MCULE-4997792867 0.68 C1(CCCCC1)C=CC1CCCCC1
MCULE-4899275665 0.68 C/C(/C)=C/CCC(N)(C)C
MCULE-3832720881 0.68 C(/C)(\C)=C\CCC(C)=O
MCULE-6619141408 0.68 C1CC2CC(=C3CC4CCC5CCC3C54[H])C3CCC1C23[H]
MCULE-3670824396 0.68 [H]C(CC=C)=C(CCCC=C)[H]
MCULE-9605328516 0.68 C(CC)(C)(C)C1CC=CCC1
MolPort-006-129-585 0.68 CC(C)=CCCC(C)=CC=C
MolPort-006-123-805 0.68 CC(N)CCC=C(C)C
MolPort-003-960-166 0.68 CCC(C)C(=O)\C=C\C
MolPort-001-769-721 0.68 CC(CCC=C(C)C)C=O
MolPort-003-926-424 0.68 C1CCC=CCC1
MolPort-001-788-424 0.68 CC(C)=CCCC(C)=O
MolPort-006-113-308 0.68 CC1=CCCCCC1
MolPort-001-769-758 0.68 CCCC\C=C\C=O
MolPort-002-501-771 0.68 CC(O)CCC=C(C)C
MolPort-028-746-495 0.68 C[C@H](O)CCC=C(C)C
MolPort-035-766-462 0.68 C1[C@H]2C[C@H]3C[C@@H]1C[C@@H](C2)C3=C1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2
MolPort-020-006-062 0.68 C[C@@H](O)CCC=C(C)C
MolPort-019-998-091 0.68 CC(C)=CCC\C(C)=C\C=C
MCULE-6864358337 0.68 C1C(C(C)C)=CCC(C(C)C)C1
MCULE-8304952110 0.68 C/C(/C)=C/CCC(C#N)(C)C
MCULE-8052625701 0.68 C1CC2CC2CCC=C1
MCULE-4949418143 0.68 C(C1C2CC(CC2)C1)C1CC=CC1
MCULE-8763605616 0.68 CCCCCC=CC=C
MCULE-9571175453 0.68 C(/CC=C)=C/CCCC=C
MCULE-8565634937 0.68 C(=CCC(C)CC/C=C(\C)/C)C=C
MCULE-6765236802 0.68 C(/C)(\C)=C/CCC(C)C=O
MCULE-8350979001 0.68 C1C2(CC2)CC=CC1
MCULE-4514853156 0.68 C1CCC=CCC1
MCULE-8312535251 0.67 C1C(CC)C=CC1
MCULE-6629961438 0.67 [H]C(CCC)=C(C(C)(C)C)[H]
MCULE-1451393701 0.67 C=CC(C)CC=CC
MolPort-003-931-654 0.67 CCC\C=C\CCC
MolPort-001-787-059 0.67 CCC\C=C\CC
MolPort-035-785-304 0.67 CC\C=C\C(C)CC
MCULE-1027409234 0.65 C(C1CCC=CC1)=C
MCULE-4511536727 0.65 C/C(/C)=C/CC1(CC=CC1)N
MCULE-3023312584 0.65 C1C=CC(C2C=CCCCCC2)CCCC1
MCULE-6038724907 0.65 CC1([C@@]2(C[C@]1(CC=C2C)[H])[H])C
MCULE-5926246821 0.65 C1(CCC=CC1)C=CC1CCC=CC1
MCULE-6522324289 0.65 CC(C1(C(/C=C(\C)/C)=O)CC1)C
MCULE-6869708319 0.65 C(/CC(C/C=C(/C)\C)C(C)=O)=C(\C)/C
MCULE-5334604577 0.65 C12(C)CCCC31C(C)CCC3(C)C(C)=C2
MCULE-4741815186 0.65 [C@H]12C(C)=CC[C@H](C1(C)C)C2
MCULE-8841070058 0.65 C#CCC1CC=CC1
MCULE-1740726456 0.65 C/C(/C)=C/CCC1CCCCCCC=1
MCULE-3537216178 0.65 C=CCCC1CCCCCCC=1
MCULE-5575647926 0.65 C(C1CCCCCCC=1)C1CC=CC1
MCULE-2562452387 0.65 [H]C12C(C)(C)C=CCC1(C)C1CC=C3C4(CC(C)(C)CCC4(C)CCC3(C)C1(C)CC2)[H]
MCULE-4190611003 0.65 CC(C1(C(/C=C(\C)/C)N)CC1)C
MCULE-3867013572 0.65 [C@H]12C(C)=CC[C@H](C1(C)C)C2
MCULE-1866915059 0.65 CC(C1(CC=CC1)N)C=C
MCULE-3589656574 0.65 C12C(C)=CCC(C1(C)C)C2
MCULE-3292738983 0.65 C12(C)CCC(C(C)C)=C1CCC(C)CC2
MCULE-3321766552 0.65 CC(C1(C(/C=C(\C)/C)O)CC1)C
MCULE-5806529301 0.65 NC1(CC=CC1)CC=C
MCULE-9517075644 0.65 CC=CCC1(CC=CC1)N
MCULE-6411421695 0.65 CCC1(CC=CC1)CN
MCULE-5651918690 0.65 C1C/C(=C/C#N)/CC1
MCULE-7493190737 0.65 C1CCC2CCC3CCCC4C3=C2C1CC4
MCULE-1981261517 0.65 NCCC1CC=CC1
MCULE-8520270175 0.65 C12([H])C=CC3([H])CCC([H])(CC1)C23[H]
MCULE-3359375571 0.65 CCC(CC)C=CC=C
MolPort-046-792-834 0.65 [Cl-].[Cl-].[Cl-].[Cl-].[Rh+3].[Rh+3].CC1[C-](C)C(C)C(C)=C1C.CC1[C-](C)C(C)C(C)=C1C
MolPort-044-559-951 0.65 [Cl-].[Cl-].[Ir].[Ir].C1CCC\C=C/CC1.C1CCC\C=C/CC1.C1CCC\C=C/CC1.C1CCC\C=C/CC1
MolPort-001-783-542 0.65 N#CC=C1CCCC1
MolPort-045-999-272 0.65 CC1(C)C2CC1C=CC2
MolPort-002-507-223 0.65 CC1=CC[C@H]2C[C@@H]1C2(C)C
MolPort-003-926-536 0.65 CC1=CCC2CC1C2(C)C
MolPort-003-928-067 0.65 CC(C)C1=CCC(C)=CC1
MolPort-003-928-859 0.65 CC1=CC[C@@H]2C[C@H]1C2(C)C
MolPort-002-506-925 0.65 CC(C)=CCC(CC=C(C)C)C(C)=O
MolPort-009-019-391 0.65 CCCCCCCCCCCCCCC\C=C/CC\C=C/CCCCCC
MolPort-002-501-801 0.65 C1CC(CC=C1)\C=C\C1CCC=CC1
MolPort-046-203-637 0.65 NC1(CC=C)CC=CC1
MolPort-044-175-406 0.65 CCCCC=CCBr
MCULE-2718294027 0.64 C1C(C1)CC=C
MCULE-3800589553 0.64 C(C)(CC(C)(CC)CC)=C
MolPort-035-385-967 0.62 CC1C[C@@H]2[C@H](C=C1)C2(C)C
MolPort-039-239-671 0.62 CC(CCC=C(C)C)C(C)C=O
MolPort-042-684-234 0.62 CC(CC=C(C)C)C(C)=CCO
MolPort-044-586-593 0.62 Cl.NCCC1CC=CC1
MolPort-044-637-519 0.62 CC1=C2CC\C(C)=C\CCC(=C)CCC(CC1)C2(C)C
MolPort-044-724-119 0.62 CC1=CCCC(=C)C2CC(C)(C)C2CC1
MolPort-044-562-385 0.62 C\C1=C/CC(C)(C)\C=C\C\C(C)=C/CC1
MolPort-046-202-953 0.62 BrC\C=C\C1CCC1
MolPort-046-508-334 0.62 CCCCCC=CCO
MolPort-046-508-417 0.62 OCC1(CC=C)CC=CC1
MolPort-046-766-038 0.62 [2H]\C(CO)=C(\C([2H])([2H])[2H])C([2H])([2H])CC=C(C)C
MolPort-044-755-235 0.62 CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4CC=CC[C@]4(C)[C@H]3CC[C@]12C
MolPort-046-693-508 0.62 C\C1=C\CC(C)(C)\C=C/C\C(C)=C/CC1
MolPort-001-787-090 0.62 CC(=C)CC(C)(C)C
MolPort-001-787-552 0.62 CC(CCC=C(C)C)CC=O
MolPort-003-936-163 0.62 C\C1=C/CC(C)(C)\C=C\C\C(C)=C\CC1
MolPort-003-960-114 0.62 CCCC\C=C\C(C)=O
MolPort-003-960-122 0.62 CCCC\C=C/CCO
MolPort-003-960-163 0.62 CC\C=C/CCCCO
MolPort-001-783-101 0.62 CC(C)=CCCC(C)(O)C=C
MolPort-001-793-806 0.62 CCC(C)=C(C)C
MCULE-5939427419 0.62 Cl.NCCC1CC=CC1
MCULE-8327062145 0.62 [C@@]123[C@H](C)CC[C@@]1([H])C([C@H](C(C)=CC2)C3)(C)C
MCULE-2718905302 0.62 C/C(/C)=C/CCC1CCCCCC=1
MCULE-5616785989 0.62 C12(C)C(C)CCC=C1CCC(C(C)=C)C2
MCULE-7038834056 0.62 C1CC2CC2CC=1
MCULE-9491384809 0.62 CC=CCC=CCCCCC
MCULE-1070537748 0.62 [H]C12CCCC1(C)C1(CCC3(C)C(C(C)C=CC(C)C(C)C)CCC3C1=CC2)[H]
MCULE-4204888723 0.62 C(/C)(\C)=C/CCC(C)CCO
MCULE-5850991547 0.62 C(/C)(\C)=C/CCC(C)C(C)O
MCULE-2407576698 0.62 C(=C)C(C)(CC/C=C(\C)/C)O
MCULE-4061101233 0.62 C1CC(C)=C2CCC(C)=CCCC(=C)CCC1C2(C)C
MCULE-3959108903 0.62 FC(CC1CC=CC1)(F)F
MCULE-2883789551 0.62 C1(CC)(CCl)CC=CC1
MCULE-3830466502 0.62 C1(CC)(CBr)CC=CC1
MCULE-9087397344 0.62 C1(C(C)(C)C)C2([H])CCCC2([H])C=1
MCULE-4790521220 0.62 C1CC2C(C)(C)C2CC=1
MCULE-3170768327 0.62 C1CC2(C)CC2(C)CC=1
MCULE-5192933185 0.62 C([H])(CCCC)=C([H])CCCCO
MCULE-7060438486 0.62 C1(CCl)(CC=CC1)C(C)C
MCULE-9720211636 0.62 [C@@]12([H])CCC(C)=CCCC(=C)[C@@]1([H])CC2(C)C
MCULE-7201475262 0.62 C12C(C1CC=CC2)(C)[H]
MCULE-4227190152 0.62 C1(C(C)C)C2([H])CCCC2([H])C=1
MCULE-4870239930 0.62 C1CC2C(=C3C4CCCCC34)C2CC1
MCULE-8579585536 0.62 C12(C)C=CC1(C)CCC2
MCULE-4374054066 0.62 C12C(CCC=C(C)CCC1C(C)(C)C2)=C
MCULE-4232398028 0.62 C(/C)(\C)=C/CCC(C)=CCN
MCULE-6271009692 0.62 C(C1CCCCCC=1)C1CC=CC1
MCULE-5051897823 0.62 C12C(C)(C)CCCC1(C)C1CCC3(C)CCCC3C1CC=2
MCULE-7916897836 0.62 N#CC=C(C)CC/C=C(/C)\C
MCULE-8864677718 0.62 C12(C(C1)CCC=C2C)C
MCULE-3900892809 0.62 C(/C)(\C)=C/CC[C@H](C)CCO
MCULE-9192624300 0.62 C/C(=C\CC/C(=C\CO)/C)/C
MCULE-4399439382 0.62 C(/C)(\C)=C/CC[C@@H](C)CCO
MCULE-3106478848 0.62 [C@@]12([H])CCC(C)=CCCC(=C)[C@@]1([H])CC2(C)C
MCULE-8444624529 0.62 C12C=CC1(C)CCC2C
MCULE-8214516455 0.62 C12CCCCC1(C)C1CCC3(C)C(C(C)CCCC(C)C)CCC3C1CC=2
MCULE-5756833407 0.62 [C@]12(C)[C@H](C)CCC=C1CC[C@@H](C(=C)C)C2
MCULE-7880343136 0.62 C1CC(C2CCCC=C2)C=CC1
MCULE-4588166214 0.62 [H]C12CCC=CC1(C)C1CCC3(C)CCCC3C1CC2
MCULE-5503440064 0.62 [H]C12C(C)(C)CC=CC1(C)C1CCC3(C4(C(C(C)C)CCC4(C)CCC3(C)C1(C)CC2)[H])[H]
MCULE-3946157075 0.62 C(/C)(\C)=C/CC[C@@H](C)CCO
MCULE-9442424770 0.62 C/C(/C)=C/CC/C(/C)=C/CO
MCULE-4783414409 0.62 C/C(/C)=C/CC[C@](O)(C)C=C
MCULE-3644985415 0.62 [H]C12CCCC1(C)C1CC=C3C4(C(C)C(C)CCC4(C)CCC3(C)C1(C)CC2)[H]
MCULE-1265880444 0.62 C12CC31CCCCCCCCCCCCC(=CC3)C2
MCULE-9758894215 0.62 C12(C)CC=CC1(C)C1CC2CC1
MCULE-7795984748 0.62 CCCCCC=C/C=C(\C)/C
MCULE-4309089675 0.62 CC=C1C(C)(C)C(N)C1
MCULE-9345089020 0.62 C1CC2C(C)(C)C3C(C)=CCC2(C3)C1C
MCULE-2811504753 0.62 C1C2C(C)(C)C2CC=C1C
MCULE-3630781826 0.62 C(C=O)=C(C)CC/C=C(/C)\C
MCULE-8068904503 0.62 C12CCCC31CC(C=C3)C2
MCULE-2407386794 0.62 [C@@H](C)(CCO)CC/C=C(\C)/C
MCULE-9530484176 0.62 C1(CBr)(CC=CC1)C(C)C
MCULE-2464501012 0.62 C/C(/C)=C1\C(C)(C)C(N)C\1
MCULE-8438901369 0.62 C/C(/C)=C/CCC(C)=CCO
MCULE-1170963979 0.62 CCC(CC/C=C(\C)/C)(O)C
MCULE-5025554030 0.62 FC(CC1CC=CC1)F
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