Vitas-M small molecule compound
2-phenylethyl 2-methyl-5-oxo-4-(4-propoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK097178
SMILES CCCOc1ccc(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 C28H31NO4 MW 445.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO4/c1-3-17-32-22-14-12-21(13-15-22)26-25(19(2)29-23-10-7-11-24(30)27(23)26)28(31)33-18-16-20-8-5-4-6-9-20/h4-6,8-9,12-15,26,29H,3,7,10-11,16-18H2,1-2H3InChIKey
VTAUTJAZIHITQQ-UHFFFAOYSA-NSynonyms
2phenylethyl2methyl5oxo4(4propoxyphenyl)145678hexahydroquinoline3carboxylate
2phenylethyl2methyl5oxo4(4propoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
CCCOC1=CC=C(C=C1)C2C3=C(CCCC3=O)NC(=C2C(=O)OCCC4=CC=CC=C4)C
CCCOc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCCc1ccccc1
InChI=1SC28H31NO4c13173222141221(131522)2625(19(2)29231071124(30)27(23)26)28(31)331816208546920h468912152629H3710111618H212H3
MFCD02104399
STK097178
ZINC000008426804
ZINC000008426805
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