Vitas-M small molecule compound
ethyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402445
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OCC)O)C(=O)CC(C2)c1ccccc1
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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 C27H29NO5 MW 447.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29NO5/c1-4-32-23-15-18(11-12-21(23)29)25-24(27(31)33-5-2)16(3)28-20-13-19(14-22(30)26(20)25)17-9-7-6-8-10-17/h6-12,15,19,25,28-29H,4-5,13-14H2,1-3H3InChIKey
QXRLVKACWMBLBR-UHFFFAOYSA-NSynonyms
CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC(=C2C(=O)OCC)C)O
ethyl4(3ethoxy4hydroxyphenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
ethyl4(3ethoxy4hydroxyphenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
InChI=1SC27H29NO5c1432231518(111221(23)29)2524(27(31)3352)16(3)28201319(1422(30)26(20)25)1797681017h6121519252829H451314H213H3
MFCD01445571
ZINC000008892342
ZINC000008892345
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Check stock on Vitas-MAvailable files
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