Vitas-M small molecule compound
2-methylpropyl 4-(4-ethylphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK027019
SMILES CCc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccccc1)C(=O)OCC(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 C29H33NO3 MW 443.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33NO3/c1-5-20-11-13-22(14-12-20)27-26(29(32)33-17-18(2)3)19(4)30-24-15-23(16-25(31)28(24)27)21-9-7-6-8-10-21/h6-14,18,23,27,30H,5,15-17H2,1-4H3InChIKey
UAMHNFUXDDMCPH-UHFFFAOYSA-NSynonyms
2methylpropyl4(4ethylphenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
2methylpropyl4(4ethylphenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
CCC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC(=C2C(=O)OCC(C)C)C
CCc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccccc1)C(=O)OCC(C)C
InChI=1SC29H33NO3c1520111322(141220)2726(29(32)331718(2)3)19(4)30241523(1625(31)28(24)27)2197681021h61418232730H51517H214H3
MFCD01445643
STK027019
ZINC000008742242
ZINC000008742245
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