Vitas-M small molecule compound
cyclopentyl 4-(4-hydroxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372414
SMILES COc1cc(ccc1O)C1C(=C(C)NC2=C1C(=O)CCC2)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 C23H27NO5 MW 397.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO5/c1-13-20(23(27)29-15-6-3-4-7-15)21(14-10-11-17(25)19(12-14)28-2)22-16(24-13)8-5-9-18(22)26/h10-12,15,21,24-25H,3-9H2,1-2H3InChIKey
TUNLETNTEQAXQM-UHFFFAOYSA-NSynonyms
299453-08-0299453080
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)O)OC)C(=O)OC4CCCC4
cyclopentyl4(4hydroxy3methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
cyclopentyl4(4hydroxy3methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC23H27NO5c11320(23(27)2915634715)21(14101117(25)19(1214)282)2216(2413)85918(22)26h101215212425H39H212H3
MFCD00752980
ZINC000019637796
ZINC000019637800
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