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]leucyl}imino)-5-methyl-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL542468
SMILES COC(=O)c1[nH]/c(=N/C(=O)C(Nc2ccc3c(cc2=O)C(CCc2c3c(OC)c(c(c2)OC)OC)NC(=O)C)CC(C)C)/sc1C
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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 C33H40N4O8S MW 652.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H40N4O8S/c1-16(2)13-24(31(40)37-33-36-28(17(3)46-33)32(41)45-8)35-23-12-10-20-21(15-25(23)39)22(34-18(4)38)11-9-19-14-26(42-5)29(43-6)30(44-7)27(19)20/h10,12,14-16,22,24H,9,11,13H2,1-8H3,(H,34,38)(H,35,39)(H,36,37,40)InChIKey
ZOCZQBURGGNVEX-UHFFFAOYSA-NSynonyms
75357151
InChI=1SC33H40N4O8Sc116(2)1324(31(40)37333628(17(3)4633)32(41)458)352312102021(1525(23)39)22(3418(4)38)119191426(425)29(436)30(447)27(19)20h101214162224H91113H218H3(H3438)(H3539)(H363740)
methyl(2Z)2(((Z)N(7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)leucyl)imino)5methyl23dihydro13thiazole4carboxylate
methyl2((2((7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)4methylpentanoyl)amino)5methyl13thiazole4carboxylate
MFCD31755629
ZINC000150653401
ZINC000206255378
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