Vitas-M small molecule compound
butan-2-yl 4-[2-(benzyloxy)phenyl]-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK022032
SMILES CCC(OC(=O)C1=C(C)NC2=C(C1c1ccccc1OCc1ccccc1)C(=O)CC(C2)c1ccc(cc1)OC)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 C35H37NO5 MW 551.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H37NO5/c1-5-22(2)41-35(38)32-23(3)36-29-19-26(25-15-17-27(39-4)18-16-25)20-30(37)34(29)33(32)28-13-9-10-14-31(28)40-21-24-11-7-6-8-12-24/h6-18,22,26,33,36H,5,19-21H2,1-4H3InChIKey
YHHURTGNBUXTMH-UHFFFAOYSA-NSynonyms
butan2yl4(2(benzyloxy)phenyl)7(4methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
butan2yl7(4methoxyphenyl)2methyl5oxo4(2phenylmethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
CCC(C)OC(=O)C1=C(NC2=C(C1C3=CC=CC=C3OCC4=CC=CC=C4)C(=O)CC(C2)C5=CC=C(C=C5)OC)C
CCC(OC(=O)C1=C(C)NC2=C(C1c1ccccc1OCc1ccccc1)C(=O)CC(C2)c1ccc(cc1)OC)C
InChI=1SC35H37NO5c1522(2)4135(38)3223(3)36291926(25151727(394)181625)2030(37)34(29)33(32)28139101431(28)402124117681224h61822263336H51921H214H3
MFCD01873721
STK022032
ZINC000100583237
ZINC000239433674
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