Vitas-M small molecule compound
2-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-11-(4-methoxyphenyl)-9-oxo-5,6,7,9-tetrahydrobenzo[9,10]heptaleno[3,2-b]furan-12-yl]-N-(2-{[(6,7-dimethoxy-4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}ethyl)acetamide
Catalog ID
STL579605
SMILES COc1ccc(cc1)c1oc2c(c1CC(=O)NCCSCc1[nH]c(=O)c3c(n1)cc(c(c3)OC)OC)cc1c(cc2=O)[C@H](CCc2c1c(OC)c(c(c2)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 C45H46N4O11S MW 850.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C45H46N4O11S/c1-23(50)47-32-13-10-25-16-37(57-5)43(58-6)44(59-7)40(25)28-17-29-30(41(24-8-11-26(54-2)12-9-24)60-42(29)34(51)18-27(28)32)20-39(52)46-14-15-61-22-38-48-33-21-36(56-4)35(55-3)19-31(33)45(53)49-38/h8-9,11-12,16-19,21,32H,10,13-15,20,2InChIKey
CSWTVSPFRAPIIG-YTTGMZPUSA-NSynonyms
(S)2(7acetamido123trimethoxy11(4methoxyphenyl)9oxo5679tetrahydrobenzo(910)heptaleno(32b)furan12yl)N(2(((67dimethoxy4oxo34dihydroquinazolin2yl)methyl)thio)ethyl)acetamide
2((7S)7(acetylamino)123trimethoxy11(4methoxyphenyl)9oxo5679tetrahydrobenzo(910)heptaleno(32b)furan12yl)N(2(((67dimethoxy4oxo34dihydroquinazolin2yl)methyl)sulfanyl)ethyl)acetamide
COc1ccc(cc1)c1oc2c(c1CC(=O)NCCSCc1(nH)c(=O)c3c(n1)cc(c(c3)OC)OC)cc1c(cc2=O)(C@H)(CCc2c1c(OC)c(c(c2)OC)OC)NC(=O)C
MFCD33397932
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