Vitas-M small molecule compound
propan-2-yl 4-[4-(benzyloxy)phenyl]-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK014882
SMILES CC(OC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)OCc1ccccc1)C(=O)CC(C2)c1ccccc1)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 C33H33NO4 MW 507.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33NO4/c1-21(2)38-33(36)30-22(3)34-28-18-26(24-12-8-5-9-13-24)19-29(35)32(28)31(30)25-14-16-27(17-15-25)37-20-23-10-6-4-7-11-23/h4-17,21,26,31,34H,18-20H2,1-3H3InChIKey
QKLNHFBYNOCREW-UHFFFAOYSA-NSynonyms
CC(OC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)OCc1ccccc1)C(=O)CC(C2)c1ccccc1)C
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)OC(C)C
InChI=1SC33H33NO4c121(2)3833(36)3022(3)34281826(24128591324)1929(35)32(28)31(30)25141627(171525)372023106471123h41721263134H1820H213H3
MFCD01825138
propan2yl2methyl5oxo7phenyl4(4phenylmethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
propan2yl4(4(benzyloxy)phenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
STK014882
ZINC000002758106
ZINC000002758109
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