Vitas-M small molecule compound
butyl 4-[4-(benzyloxy)-3-methoxyphenyl]-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK074280
SMILES CCCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OCc1ccccc1)C(=O)CC(C2)c1ccccc1
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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 C35H37NO5 MW 551.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H37NO5/c1-4-5-18-40-35(38)32-23(2)36-28-19-27(25-14-10-7-11-15-25)20-29(37)34(28)33(32)26-16-17-30(31(21-26)39-3)41-22-24-12-8-6-9-13-24/h6-17,21,27,33,36H,4-5,18-20,22H2,1-3H3InChIKey
MFRNVEBLHNEBSS-UHFFFAOYSA-NSynonyms
butyl4(3methoxy4phenylmethoxyphenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
butyl4(4(benzyloxy)3methoxyphenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
CCCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OCc1ccccc1)C(=O)CC(C2)c1ccccc1
CCCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C(=O)CC(C2)C5=CC=CC=C5)C
InChI=1SC35H37NO5c145184035(38)3223(2)36281927(2514107111525)2029(37)34(28)33(32)26161730(31(2126)393)412224128691324h61721273336H45182022H213H3
MFCD00771420
STK074280
ZINC000100850042
ZINC000100850050
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