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-(2-methylpropyl)-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL540633
SMILES CSCCC(C(=O)/N=c\1/[nH]c(c(s1)CC(C)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 C35H44N4O8S2 MW 712.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H44N4O8S2/c1-18(2)15-28-30(34(43)47-7)38-35(49-28)39-33(42)25(13-14-48-8)37-24-12-10-21-22(17-26(24)41)23(36-19(3)40)11-9-20-16-27(44-4)31(45-5)32(46-6)29(20)21/h10,12,16-18,23,25H,9,11,13-15H2,1-8H3,(H,36,40)(H,37,41)(H,38,39,42)InChIKey
LJWPEDHNPDOGIV-UHFFFAOYSA-NSynonyms
75357082
InChI=1SC35H44N4O8S2c118(2)152830(34(43)477)3835(4928)3933(42)25(1314488)372412102122(1726(24)41)23(3619(3)40)119201627(444)31(455)32(466)29(20)21h101216182325H9111315H218H3(H3640)(H3741)(H383942)
methyl(2Z)2(((Z)N(7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)methionyl)imino)5(2methylpropyl)23dihydro13thiazole4carboxylate
methyl2((2((7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)4methylsulfanylbutanoyl)amino)5(2methylpropyl)13thiazole4carboxylate
MFCD31755132
ZINC000150652989
ZINC000206253555
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