Vitas-M small molecule compound
cyclopentyl 7-(4-ethoxy-3-methoxyphenyl)-2-methyl-4-(6-methyl-4-oxo-4H-chromen-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK001325
SMILES CCOc1ccc(cc1OC)C1CC(=O)C2=C(C1)NC(=C(C2c1coc2c(c1=O)cc(cc2)C)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 C35H37NO7 MW 583.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H37NO7/c1-5-41-29-13-11-21(17-30(29)40-4)22-15-26-33(27(37)16-22)32(25-18-42-28-12-10-19(2)14-24(28)34(25)38)31(20(3)36-26)35(39)43-23-8-6-7-9-23/h10-14,17-18,22-23,32,36H,5-9,15-16H2,1-4H3InChIKey
ZTAKJJSTPDDYMB-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C2CC3=C(C(C(=C(N3)C)C(=O)OC4CCCC4)C5=COC6=C(C5=O)C=C(C=C6)C)C(=O)C2)OC
CCOc1ccc(cc1OC)C1CC(=O)C2=C(C1)NC(=C(C2c1coc2c(c1=O)cc(cc2)C)C(=O)OC1CCCC1)C
cyclopentyl7(4ethoxy3methoxyphenyl)2methyl4(6methyl4oxo4Hchromen3yl)5oxo145678hexahydroquinoline3carboxylate
cyclopentyl7(4ethoxy3methoxyphenyl)2methyl4(6methyl4oxochromen3yl)5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC35H37NO7c154129131121(1730(29)404)22152633(27(37)1622)32(25184228121019(2)1424(28)34(25)38)31(20(3)3626)35(39)4323867923h1014171822233236H591516H214H3
MFCD03489182
STK001325
ZINC000097939745
ZINC000097939748
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