Vitas-M small molecule compound
propan-2-yl 4-[4-(benzyloxy)-3-methoxyphenyl]-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK079956
SMILES COc1cc(ccc1OCc1ccccc1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccccc1)C(=O)OC(C)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 C34H35NO5 MW 537.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H35NO5/c1-21(2)40-34(37)31-22(3)35-27-17-26(24-13-9-6-10-14-24)18-28(36)33(27)32(31)25-15-16-29(30(19-25)38-4)39-20-23-11-7-5-8-12-23/h5-16,19,21,26,32,35H,17-18,20H2,1-4H3InChIKey
QZUOLJPLVDZZEN-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC(=C(C=C4)OCC5=CC=CC=C5)OC)C(=O)OC(C)C
COc1cc(ccc1OCc1ccccc1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccccc1)C(=O)OC(C)C
InChI=1SC34H35NO5c121(2)4034(37)3122(3)35271726(241396101424)1828(36)33(27)32(31)25151629(30(1925)384)392023117581223h5161921263235H171820H214H3
MFCD00771320
propan2yl4(3methoxy4phenylmethoxyphenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
propan2yl4(4(benzyloxy)3methoxyphenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
STK079956
ZINC000100636184
ZINC000100636190
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