Vitas-M small molecule compound
2-phenylethyl 4-(4-ethylphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK006810
SMILES CCc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCCc1ccccc1
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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 C27H29NO3 MW 415.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29NO3/c1-3-19-12-14-21(15-13-19)25-24(18(2)28-22-10-7-11-23(29)26(22)25)27(30)31-17-16-20-8-5-4-6-9-20/h4-6,8-9,12-15,25,28H,3,7,10-11,16-17H2,1-2H3InChIKey
SJDLDIRFIIVHKS-UHFFFAOYSA-NSynonyms
2phenylethyl4(4ethylphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenylethyl4(4ethylphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCC1=CC=C(C=C1)C2C3=C(CCCC3=O)NC(=C2C(=O)OCCC4=CC=CC=C4)C
CCc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCCc1ccccc1
InChI=1SC27H29NO3c1319121421(151319)2524(18(2)28221071123(29)26(22)25)27(30)311716208546920h468912152528H3710111617H212H3
MFCD01193808
STK006810
ZINC000000844334
ZINC000000844335
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