Vitas-M small molecule compound
ethyl 4-(4-hydroxy-3-methoxyphenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK062812
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)O)C(=O)CC(C2)c1ccc(cc1)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/c1-5-34-27(31)24-15(2)28-20-12-18(16-6-9-19(32-3)10-7-16)13-22(30)26(20)25(24)17-8-11-21(29)23(14-17)33-4/h6-11,14,18,25,28-29H,5,12-13H2,1-4H3InChIKey
OONNRBZHKYHTDL-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)O)C(=O)CC(C2)c1ccc(cc1)OC
CCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)O)OC)C(=O)CC(C2)C4=CC=C(C=C4)OC)C
ethyl4(4hydroxy3methoxyphenyl)7(4methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
ethyl4(4hydroxy3methoxyphenyl)7(4methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC27H29NO6c153427(31)2415(2)28201218(166919(323)10716)1322(30)26(20)25(24)1781121(29)23(1417)334h6111418252829H51213H214H3
MFCD01445604
STK062812
ZINC000000847595
ZINC000000847598
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