Vitas-M small molecule compound
pentyl 2-methyl-4-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363234
SMILES CCCCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)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 C23H29NO3 MW 367.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO3/c1-4-5-6-14-27-23(26)20-16(3)24-18-8-7-9-19(25)22(18)21(20)17-12-10-15(2)11-13-17/h10-13,21,24H,4-9,14H2,1-3H3InChIKey
OCCZJOKETJTYRD-UHFFFAOYSA-NSynonyms
CCCCCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)C)C(=O)CCC2)C
InChI=1SC23H29NO3c1456142723(26)2016(3)241887919(25)22(18)21(20)17121015(2)111317h10132124H4914H213H3
MFCD00753258
pentyl2methyl4(4methylphenyl)5oxo145678hexahydroquinoline3carboxylate
pentyl2methyl4(4methylphenyl)5oxo4678tetrahydro1Hquinoline3carboxylate
ZINC000002055373
ZINC000002055374
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