Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 2-methyl-4-(3-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK039872
SMILES Cc1cccc(c1)C1C(=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 C23H27NO4 MW 381.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO4/c1-14-6-3-7-16(12-14)21-20(23(26)28-13-17-8-5-11-27-17)15(2)24-18-9-4-10-19(25)22(18)21/h3,6-7,12,17,21,24H,4-5,8-11,13H2,1-2H3InChIKey
LNGGVOLRPROADS-UHFFFAOYSA-NSynonyms
CC1=CC=CC(=C1)C2C3=C(CCCC3=O)NC(=C2C(=O)OCC4CCCO4)C
Cc1cccc(c1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCC1CCCO1
InChI=1SC23H27NO4c11463716(1214)2120(23(26)28131785112717)15(2)2418941019(25)22(18)21h36712172124H4581113H212H3
MFCD02104392
oxolan2ylmethyl2methyl4(3methylphenyl)5oxo4678tetrahydro1Hquinoline3carboxylate
STK039872
tetrahydrofuran2ylmethyl2methyl4(3methylphenyl)5oxo145678hexahydroquinoline3carboxylate
ZINC000000709900
ZINC000000709903
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