Vitas-M small molecule compound
methyl 7-(4-methoxyphenyl)-2-methyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK016784
SMILES COc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1ccccc1)C(=O)OC)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 C25H25NO4 MW 403.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO4/c1-15-22(25(28)30-3)23(17-7-5-4-6-8-17)24-20(26-15)13-18(14-21(24)27)16-9-11-19(29-2)12-10-16/h4-12,18,23,26H,13-14H2,1-3H3InChIKey
GBLXGHIVLSYURK-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)OC)C4=CC=CC=C4)C(=O)OC
COc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1ccccc1)C(=O)OC)C
InChI=1SC25H25NO4c11522(25(28)303)23(177546817)2420(2615)1318(1421(24)27)1691119(292)121016h412182326H1314H213H3
methyl7(4methoxyphenyl)2methyl5oxo4phenyl145678hexahydroquinoline3carboxylate
methyl7(4methoxyphenyl)2methyl5oxo4phenyl4678tetrahydro1Hquinoline3carboxylate
MFCD02632902
STK016784
ZINC000019907416
ZINC000019907421
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