Vitas-M small molecule compound
methyl 7-chloro-5'-hydroxy-4,6-dimethoxy-4'-(4-methoxyphenyl)-2',7'-dimethyl-3-oxo-7',8'-dihydro-3H,4'H-spiro[1-benzofuran-2,6'-quinoline]-3'-carboxylate
Catalog ID
STL550363
SMILES COc1ccc(cc1)C1C(=C(C)N=C2C1=C(O)C1(C(C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC)C(=O)OC
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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 C29H28ClNO8 MW 554.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28ClNO8/c1-13-11-17-22(21(15-7-9-16(35-3)10-8-15)20(14(2)31-17)28(34)38-6)26(32)29(13)27(33)23-18(36-4)12-19(37-5)24(30)25(23)39-29/h7-10,12-13,21,32H,11H2,1-6H3InChIKey
CKICUEKHKPMLEU-UHFFFAOYSA-NSynonyms
InChI=1SC29H28ClNO8c113111722(21(157916(353)10815)20(14(2)3117)28(34)386)26(32)29(13)27(33)2318(364)1219(375)24(30)25(23)3929h71012132132H11H216H3
methyl7chloro5hydroxy46dimethoxy4(4methoxyphenyl)27dimethyl3oxo78dihydro3H4Hspiro(1benzofuran26quinoline)3carboxylate
MFCD31757548
ZINC000888089012
ZINC000888089015
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Check stock on Vitas-MAvailable files
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