Vitas-M small molecule compound
2-methylpropyl 4-[4-(acetyloxy)-3-methoxyphenyl]-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363793
SMILES COc1cc(ccc1OC(=O)C)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 C30H33NO6 MW 503.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33NO6/c1-17(2)16-36-30(34)27-18(3)31-23-13-22(20-9-7-6-8-10-20)14-24(33)29(23)28(27)21-11-12-25(37-19(4)32)26(15-21)35-5/h6-12,15,17,22,28,31H,13-14,16H2,1-5H3InChIKey
ZJNRULCCWZBPKR-UHFFFAOYSA-NSynonyms
2methylpropyl4(4(acetyloxy)3methoxyphenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
2methylpropyl4(4acetyloxy3methoxyphenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC(=C(C=C4)OC(=O)C)OC)C(=O)OCC(C)C
InChI=1SC30H33NO6c117(2)163630(34)2718(3)31231322(2097681020)1424(33)29(23)28(27)21111225(3719(4)32)26(1521)355h6121517222831H131416H215H3
MFCD01824427
ZINC000019881032
ZINC000019881041
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