Vitas-M small molecule compound
cycloheptyl 4-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403040
SMILES COc1ccc(cc1OC)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC1CCCCCC1
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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 C26H33NO5 MW 439.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33NO5/c1-16-23(26(29)32-18-9-6-4-5-7-10-18)24(25-19(27-16)11-8-12-20(25)28)17-13-14-21(30-2)22(15-17)31-3/h13-15,18,24,27H,4-12H2,1-3H3InChIKey
QLIGRPFLGWRHCX-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)OC)OC)C(=O)OC4CCCCCC4
cycloheptyl4(34dimethoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
cycloheptyl4(34dimethoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC26H33NO5c11623(26(29)3218964571018)24(2519(2716)1181220(25)28)17131421(302)22(1517)313h1315182427H412H213H3
MFCD03371050
ZINC000001152103
ZINC000001152104
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