Vitas-M small molecule compound
N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-pyridin-3-yl-L-methioninamide
Catalog ID
STL540061
SMILES CSCC[C@@H](C(=O)Nc1cccnc1)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
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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 C31H36N4O6S MW 592.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36N4O6S/c1-18(36)33-23-10-8-19-15-27(39-2)29(40-3)30(41-4)28(19)21-9-11-24(26(37)16-22(21)23)35-25(12-14-42-5)31(38)34-20-7-6-13-32-17-20/h6-7,9,11,13,15-17,23,25H,8,10,12,14H2,1-5H3,(H,33,36)(H,34,38)(H,35,37)/t23-,25-/m0/s1InChIKey
JEGRLZZLAOCDFT-ZCYQVOJMSA-NSynonyms
1574379-45-5(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)4methylsulfanyl~(N)pyridin3ylbutanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)4(methylthio)N(pyridin3yl)butanamide
1574379455
75492474
CSCC(C@@H)(C(=O)Nc1cccnc1)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC31H36N4O6Sc118(36)3323108191527(392)29(403)30(414)28(19)2191124(26(37)1622(21)23)3525(1214425)31(38)34207613321720h679111315172325H8101214H215H3(H3336)(H3438)(H3537)t2325m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)Npyridin3ylLmethioninamide
ZINC000108451276
ZINC108451276
Check stock
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Check stock on Vitas-MAvailable files
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