Vitas-M small molecule compound
methyl (2Z)-2-({(Z)-N-[7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]methionyl}imino)-5-methyl-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL541585
SMILES CSCCC(C(=O)/N=c\1/[nH]c(c(s1)C)C(=O)OC)Nc1ccc2c(cc1=O)C(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 C32H38N4O8S2 MW 670.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H38N4O8S2/c1-16-27(31(40)44-6)35-32(46-16)36-30(39)23(12-13-45-7)34-22-11-9-19-20(15-24(22)38)21(33-17(2)37)10-8-18-14-25(41-3)28(42-4)29(43-5)26(18)19/h9,11,14-15,21,23H,8,10,12-13H2,1-7H3,(H,33,37)(H,34,38)(H,35,36,39)InChIKey
IFMLCGVRIZXVQS-UHFFFAOYSA-NSynonyms
75357161
InChI=1SC32H38N4O8S2c11627(31(40)446)3532(4616)3630(39)23(1213457)34221191920(1524(22)38)21(3317(2)37)108181425(413)28(424)29(435)26(18)19h91114152123H8101213H217H3(H3337)(H3438)(H353639)
methyl(2Z)2(((Z)N(7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)methionyl)imino)5methyl23dihydro13thiazole4carboxylate
methyl2((2((7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)4methylsulfanylbutanoyl)amino)5methyl13thiazole4carboxylate
MFCD31755384
ZINC000150653599
ZINC000206255720
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