Vitas-M small molecule compound
cyclopentyl 4-(2,3-dimethoxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK070293
SMILES COc1cccc(c1OC)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccccc1)C(=O)OC1CCCC1
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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 C30H33NO5 MW 487.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33NO5/c1-18-26(30(33)36-21-12-7-8-13-21)27(22-14-9-15-25(34-2)29(22)35-3)28-23(31-18)16-20(17-24(28)32)19-10-5-4-6-11-19/h4-6,9-11,14-15,20-21,27,31H,7-8,12-13,16-17H2,1-3H3InChIKey
MVMLAIXRVATISP-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=C(C(=CC=C4)OC)OC)C(=O)OC5CCCC5
COc1cccc(c1OC)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccccc1)C(=O)OC1CCCC1
cyclopentyl4(23dimethoxyphenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
cyclopentyl4(23dimethoxyphenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
InChI=1SC30H33NO5c11826(30(33)362112781321)27(221491525(342)29(22)353)2823(3118)1620(1724(28)32)19105461119h46911141520212731H7812131617H213H3
MFCD02632935
STK070293
ZINC000001203276
ZINC000001203295
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