Vitas-M small molecule compound
prop-2-en-1-yl 2,7,7-trimethyl-4-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372562
SMILES C=CCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)C)C(=O)CC(C2)(C)C
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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 C23H27NO3 MW 365.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO3/c1-6-11-27-22(26)19-15(3)24-17-12-23(4,5)13-18(25)21(17)20(19)16-9-7-14(2)8-10-16/h6-10,20,24H,1,11-13H2,2-5H3InChIKey
QSUHGKQRKSOQAI-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)OCC=C)C
InChI=1SC23H27NO3c16112722(26)1915(3)24171223(45)1318(25)21(17)20(19)169714(2)81016h6102024H11113H225H3
MFCD00753136
prop2en1yl277trimethyl4(4methylphenyl)5oxo145678hexahydroquinoline3carboxylate
prop2enyl277trimethyl4(4methylphenyl)5oxo1468tetrahydroquinoline3carboxylate
ZINC000004066175
ZINC000004066176
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