Vitas-M small molecule compound
2-phenoxyethyl 4,7-bis(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK086738
SMILES COc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccc(cc1)OC)C(=O)OCCOc1ccccc1
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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 C33H33NO6 MW 539.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33NO6/c1-21-30(33(36)40-18-17-39-27-7-5-4-6-8-27)31(23-11-15-26(38-3)16-12-23)32-28(34-21)19-24(20-29(32)35)22-9-13-25(37-2)14-10-22/h4-16,24,31,34H,17-20H2,1-3H3InChIKey
NIGBWNJXNMUPDJ-UHFFFAOYSA-NSynonyms
2phenoxyethyl47bis(4methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenoxyethyl47bis(4methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)C(=O)OCCOC5=CC=CC=C5
COc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccc(cc1)OC)C(=O)OCCOc1ccccc1
InChI=1SC33H33NO6c12130(33(36)40181739277546827)31(23111526(383)161223)3228(3421)1924(2029(32)35)2291325(372)141022h416243134H1720H213H3
MFCD01823616
STK086738
ZINC000002927406
ZINC000002927416
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