Vitas-M small molecule compound
cycloheptyl 4-(2,5-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403028
SMILES COc1ccc(c(c1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC1CCCCCC1)OC
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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)32-17-9-6-4-5-7-10-17)24(25-20(27-16)11-8-12-21(25)28)19-15-18(30-2)13-14-22(19)31-3/h13-15,17,24,27H,4-12H2,1-3H3InChIKey
JEKDYNAQTMBWOO-UHFFFAOYSA-NSynonyms
510717-57-4510717574
CC1=C(C(C2=C(N1)CCCC2=O)C3=C(C=CC(=C3)OC)OC)C(=O)OC4CCCCCC4
cycloheptyl4(25dimethoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
cycloheptyl4(25dimethoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC26H33NO5c11623(26(29)3217964571017)24(2520(2716)1181221(25)28)191518(302)131422(19)313h1315172427H412H213H3
MFCD03371040
ZINC000019630155
ZINC000019630159
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