Vitas-M small molecule compound
methyl 7-chloro-5'-hydroxy-4,6-dimethoxy-2',7'-dimethyl-3-oxo-4'-(5-oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinolin-6-yl)-7',8'-dihydro-3H,4'H-spiro[1-benzofuran-2,6'-quinoline]-3'-carboxylate
Catalog ID
STL550730
SMILES COC(=O)C1=C(C)N=C2C(=C(O)C3(C(C2)C)Oc2c(C3=O)c(OC)cc(c2Cl)OC)C1c1cc2cccc3c2n(c1=O)CCC3
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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 C34H31ClN2O8 MW 631.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H31ClN2O8/c1-15-12-20-25(30(38)34(15)31(39)26-21(42-3)14-22(43-4)27(35)29(26)45-34)24(23(16(2)36-20)33(41)44-5)19-13-18-9-6-8-17-10-7-11-37(28(17)18)32(19)40/h6,8-9,13-15,24,38H,7,10-12H2,1-5H3InChIKey
OPGPWCYPEYDCGW-UHFFFAOYSA-NSynonyms
InChI=1SC34H31ClN2O8c115122025(30(38)34(15)31(39)2621(423)1422(434)27(35)29(26)4534)24(23(16(2)3620)33(41)445)191318968171071137(28(17)18)32(19)40h68913152438H71012H215H3
methyl7chloro5hydroxy46dimethoxy27dimethyl3oxo4(5oxo23dihydro1H5Hpyrido(321ij)quinolin6yl)78dihydro3H4Hspiro(1benzofuran26quinoline)3carboxylate
MFCD31757743
ZINC000888088734
ZINC000888088737
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