Vitas-M small molecule compound
propan-2-yl 7-(4-methoxyphenyl)-2-methyl-5-oxo-4-[2-(propan-2-yloxy)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK407261
SMILES COc1ccc(cc1)C1CC2=C(C(=O)C1)C(C(=C(N2)C)C(=O)OC(C)C)c1ccccc1OC(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 C30H35NO5 MW 489.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35NO5/c1-17(2)35-26-10-8-7-9-23(26)28-27(30(33)36-18(3)4)19(5)31-24-15-21(16-25(32)29(24)28)20-11-13-22(34-6)14-12-20/h7-14,17-18,21,28,31H,15-16H2,1-6H3InChIKey
SJEVRCWITSAGFZ-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)OC)C4=CC=CC=C4OC(C)C)C(=O)OC(C)C
InChI=1SC30H35NO5c117(2)35261087923(26)2827(30(33)3618(3)4)19(5)31241521(1625(32)29(24)28)20111322(346)141220h7141718212831H1516H216H3
MFCD01445666
propan2yl7(4methoxyphenyl)2methyl5oxo4(2(propan2yloxy)phenyl)145678hexahydroquinoline3carboxylate
propan2yl7(4methoxyphenyl)2methyl5oxo4(2propan2yloxyphenyl)4678tetrahydro1Hquinoline3carboxylate
ZINC000000666819
ZINC000000666830
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