Vitas-M small molecule compound
trans-4-[({S-benzyl-N-[(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-L-cysteinyl}amino)methyl]cyclohexanecarboxylic acid
Catalog ID
STK580368
SMILES COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)N[C@H](C(=O)NC[C@@H]1CC[C@H](CC1)C(=O)O)CSCc1ccccc1
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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 C31H35ClN2O7S MW 615.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H35ClN2O7S/c1-18-22-12-24(32)27(40-2)14-26(22)41-31(39)23(18)13-28(35)34-25(17-42-16-20-6-4-3-5-7-20)29(36)33-15-19-8-10-21(11-9-19)30(37)38/h3-7,12,14,19,21,25H,8-11,13,15-17H2,1-2H3,(H,33,36)(H,34,35)(H,37,38)/t19-,21-,25-/m0/s1InChIKey
FSNKQDGCZZOLOW-OWHZGTRUSA-NSynonyms
(1R4r)4(((R)3(benzylthio)2(2(6chloro7methoxy4methyl2oxo2Hchromen3yl)acetamido)propanamido)methyl)cyclohexanecarboxylicacid
COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)N(C@H)(C(=O)NC(C@@H)1CC(C@H)(CC1)C(=O)O)CSCc1ccccc1
MFCD18245649
trans4(((SbenzylN((6chloro7methoxy4methyl2oxo2Hchromen3yl)acetyl)Lcysteinyl)amino)methyl)cyclohexanecarboxylicacid
ZINC000245325560
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