Vitas-M small molecule compound
3-[(2Z)-2-(2,4-dimethoxybenzylidene)-6-hydroxy-3-oxo-2,3-dihydro-1-benzofuran-7-yl]-3-(quinolin-6-yl)propanoic acid
Catalog ID
STL550619
SMILES COc1ccc(c(c1)OC)/C=C/1\Oc2c(C1=O)ccc(c2C(c1ccc2c(c1)cccn2)CC(=O)O)O
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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 C29H23NO7 MW 497.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23NO7/c1-35-19-7-5-18(24(14-19)36-2)13-25-28(34)20-8-10-23(31)27(29(20)37-25)21(15-26(32)33)16-6-9-22-17(12-16)4-3-11-30-22/h3-14,21,31H,15H2,1-2H3,(H,32,33)/b25-13-InChIKey
WYIDPPIGZAAGEX-MXAYSNPKSA-NSynonyms
(Z)3(2(24dimethoxybenzylidene)6hydroxy3oxo23dihydrobenzofuran7yl)3(quinolin6yl)propanoicacid
127252765
3((2~(Z))2((24dimethoxyphenyl)methylidene)6hydroxy3oxo1benzofuran7yl)3quinolin6ylpropanoicacid
3((2Z)2(24dimethoxybenzylidene)6hydroxy3oxo23dihydro1benzofuran7yl)3(quinolin6yl)propanoicacid
COc1ccc(c(c1)OC)C=C1Oc2c(C1=O)ccc(c2C(c1ccc2c(c1)cccn2)CC(=O)O)O
InChI=1SC29H23NO7c135197518(24(1419)362)132528(34)2081023(31)27(29(20)3725)21(1526(32)33)16692217(1216)43113022h3142131H15H212H3(H3233)b2513
MFCD31757684
ZINC000604405917
ZINC001081803938
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