Vitas-M small molecule compound
methyl 4-(2,3-dimethoxyphenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK003470
SMILES COc1ccc(cc1)C1CC2=C(C(=O)C1)C(C(=C(N2)C)C(=O)OC)c1cccc(c1OC)OC
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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 C27H29NO6 MW 463.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29NO6/c1-15-23(27(30)34-5)24(19-7-6-8-22(32-3)26(19)33-4)25-20(28-15)13-17(14-21(25)29)16-9-11-18(31-2)12-10-16/h6-12,17,24,28H,13-14H2,1-5H3InChIKey
FPAPKNAWRIADIS-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)OC)C4=C(C(=CC=C4)OC)OC)C(=O)OC
COc1ccc(cc1)C1CC2=C(C(=O)C1)C(C(=C(N2)C)C(=O)OC)c1cccc(c1OC)OC
InChI=1SC27H29NO6c11523(27(30)345)24(1976822(323)26(19)334)2520(2815)1317(1421(25)29)1691118(312)121016h612172428H1314H215H3
methyl4(23dimethoxyphenyl)7(4methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl4(23dimethoxyphenyl)7(4methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD01445672
STK003470
ZINC000019770486
ZINC000019770489
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