Vitas-M small molecule compound
6-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-[(1-methyl-1H-benzimidazol-2-yl)methyl]hexanamide
Catalog ID
STL543602
SMILES COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1[C@H](CC2)NC(=O)C)NCCCCCC(=O)NCc1nc2c(n1C)cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C36H43N5O6 MW 641.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H43N5O6/c1-22(42)39-26-16-14-23-19-31(45-3)35(46-4)36(47-5)34(23)24-15-17-28(30(43)20-25(24)26)37-18-10-6-7-13-33(44)38-21-32-40-27-11-8-9-12-29(27)41(32)2/h8-9,11-12,15,17,19-20,26H,6-7,10,13-14,16,18,21H2,1-5H3,(H,37,43)(H,38,44)(H,39,42)/t2InChIKey
JPBXACYKVQYLFY-SANMLTNESA-NSynonyms
1630918-37-4(S)6((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N((1methyl1Hbenzo(d)imidazol2yl)methyl)hexanamide
1630918374
6(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)((1methylbenzimidazol2yl)methyl)hexanamide
6(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N((1methyl1Hbenzimidazol2yl)methyl)hexanamide
91637098
COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1(C@H)(CC2)NC(=O)C)NCCCCCC(=O)NCc1nc2c(n1C)cccc2
InChI=1SC36H43N5O6c122(42)39261614231931(453)35(464)36(475)34(23)24151728(30(43)2025(24)26)371810671333(44)382132402711891229(27)41(32)2h8911121517192026H67101314161821H215H3(H3743)(H3844)(H3942)t26m0s1
ZINC000217694484
ZINC217694484
Check stock
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Check stock on Vitas-MAvailable files
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