Vitas-M small molecule compound
ethyl 2-methyl-5-oxo-7-phenyl-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK007374
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)CC(C2)c1ccccc1
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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 C28H31NO6 MW 477.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO6/c1-6-35-28(31)24-16(2)29-20-12-18(17-10-8-7-9-11-17)13-21(30)26(20)25(24)19-14-22(32-3)27(34-5)23(15-19)33-4/h7-11,14-15,18,25,29H,6,12-13H2,1-5H3InChIKey
GMKQRRPEWIXIEP-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)CC(C2)c1ccccc1
CCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C(=C3)OC)OC)OC)C(=O)CC(C2)C4=CC=CC=C4)C
ethyl2methyl5oxo7phenyl4(345trimethoxyphenyl)145678hexahydroquinoline3carboxylate
ethyl2methyl5oxo7phenyl4(345trimethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
InChI=1SC28H31NO6c163528(31)2416(2)29201218(17108791117)1321(30)26(20)25(24)191422(323)27(345)23(1519)334h7111415182529H61213H215H3
MFCD02375963
STK007374
ZINC000001456153
ZINC000001456156
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