Vitas-M small molecule compound
benzyl 4-(3-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK407302
SMILES Oc1cccc(c1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccccc1)C(=O)OCc1ccccc1
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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 C30H27NO4 MW 465.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27NO4/c1-19-27(30(34)35-18-20-9-4-2-5-10-20)28(22-13-8-14-24(32)15-22)29-25(31-19)16-23(17-26(29)33)21-11-6-3-7-12-21/h2-15,23,28,31-32H,16-18H2,1H3InChIKey
QQBXBWOSIILNOU-UHFFFAOYSA-NSynonyms
benzyl4(3hydroxyphenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
benzyl4(3hydroxyphenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC(=CC=C4)O)C(=O)OCC5=CC=CC=C5
InChI=1SC30H27NO4c11927(30(34)35182094251020)28(221381424(32)1522)2925(3119)1623(1726(29)33)21116371221h21523283132H1618H21H3
MFCD02632944
ZINC000001456170
ZINC000100306394
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