Vitas-M small molecule compound
ethyl 4-[4-(benzyloxy)phenyl]-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK060649
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)OCc1ccccc1)C(=O)CC(C2)c1ccc(cc1)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 C33H33NO5 MW 523.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33NO5/c1-4-38-33(36)30-21(2)34-28-18-25(23-10-14-26(37-3)15-11-23)19-29(35)32(28)31(30)24-12-16-27(17-13-24)39-20-22-8-6-5-7-9-22/h5-17,25,31,34H,4,18-20H2,1-3H3InChIKey
QYPCEJDCLIVNLB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)OCc1ccccc1)C(=O)CC(C2)c1ccc(cc1)OC
CCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)CC(C2)C5=CC=C(C=C5)OC)C
ethyl4(4(benzyloxy)phenyl)7(4methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
ethyl7(4methoxyphenyl)2methyl5oxo4(4phenylmethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
InChI=1SC33H33NO5c143833(36)3021(2)34281825(23101426(373)151123)1929(35)32(28)31(30)24121627(171324)3920228657922h517253134H41820H213H3
MFCD01445739
STK060649
ZINC000019770392
ZINC000019770395
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