Vitas-M small molecule compound
4-methoxybenzyl 2-methyl-4-(6-methyl-4-oxo-4H-chromen-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402688
SMILES COc1ccc(cc1)COC(=O)C1=C(C)NC2=C(C1c1coc3c(c1=O)cc(cc3)C)C(=O)CCC2
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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 C29H27NO6 MW 485.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27NO6/c1-16-7-12-24-20(13-16)28(32)21(15-35-24)26-25(17(2)30-22-5-4-6-23(31)27(22)26)29(33)36-14-18-8-10-19(34-3)11-9-18/h7-13,15,26,30H,4-6,14H2,1-3H3InChIKey
WMMLMDUNFLETSE-UHFFFAOYSA-NSynonyms
5861-11-0(4methoxyphenyl)methyl2methyl4(6methyl4oxochromen3yl)5oxo4678tetrahydro1Hquinoline3carboxylate
4H5HPYRANO(43D)13DIOXIN45DIONE7((4METHOXYPHENYL)AMINO)22DIMETHYL
4methoxybenzyl2methyl4(6methyl4oxo4Hchromen3yl)5oxo145678hexahydroquinoline3carboxylate
5861110
CC1=CC2=C(C=C1)OC=C(C2=O)C3C4=C(CCCC4=O)NC(=C3C(=O)OCC5=CC=C(C=C5)OC)C
InChI=1SC29H27NO6c1167122420(1316)28(32)21(153524)2625(17(2)302254623(31)27(22)26)29(33)36141881019(343)11918h713152630H4614H213H3
MFCD02104458
ZINC000008426810
ZINC000008426811
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