Vitas-M small molecule compound
cyclopentyl 4-(2,5-dimethoxyphenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK069587
SMILES COc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1cc(OC)ccc1OC)C(=O)OC1CCCC1)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 C31H35NO6 MW 517.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H35NO6/c1-18-28(31(34)38-22-7-5-6-8-22)29(24-17-23(36-3)13-14-27(24)37-4)30-25(32-18)15-20(16-26(30)33)19-9-11-21(35-2)12-10-19/h9-14,17,20,22,29,32H,5-8,15-16H2,1-4H3InChIKey
AWYQMKYSPLIQKW-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)OC5CCCC5
COc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1cc(OC)ccc1OC)C(=O)OC1CCCC1)C
cyclopentyl4(25dimethoxyphenyl)7(4methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
cyclopentyl4(25dimethoxyphenyl)7(4methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC31H35NO6c11828(31(34)3822756822)29(241723(363)131427(24)374)3025(3218)1520(1626(30)33)1991121(352)121019h9141720222932H581516H214H3
MFCD01655983
STK069587
ZINC000019830887
ZINC000019830890
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