Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 4-(2-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK005332
SMILES COc1ccccc1C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCC1CCCO1
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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 C23H27NO5 MW 397.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO5/c1-14-20(23(26)29-13-15-7-6-12-28-15)21(16-8-3-4-11-19(16)27-2)22-17(24-14)9-5-10-18(22)25/h3-4,8,11,15,21,24H,5-7,9-10,12-13H2,1-2H3InChIKey
VRVRAGGWXCIIEL-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=CC=C3OC)C(=O)OCC4CCCO4
COc1ccccc1C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCC1CCCO1
InChI=1SC23H27NO5c11420(23(26)29131576122815)21(168341119(16)272)2217(2414)951018(22)25h34811152124H579101213H212H3
MFCD01445705
oxolan2ylmethyl4(2methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
STK005332
tetrahydrofuran2ylmethyl4(2methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
ZINC000019770319
ZINC000019770322
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