Vitas-M small molecule compound
cyclohexyl 4-[4-(acetyloxy)phenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372496
SMILES CC(=O)Oc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC1CCCCC1
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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 C25H29NO5 MW 423.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29NO5/c1-15-22(25(29)31-18-7-4-3-5-8-18)23(24-20(26-15)9-6-10-21(24)28)17-11-13-19(14-12-17)30-16(2)27/h11-14,18,23,26H,3-10H2,1-2H3InChIKey
UIWPZGOXFIUCAR-UHFFFAOYSA-NSynonyms
299945-71-4299945714
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)OC(=O)C)C(=O)OC4CCCCC4
cyclohexyl4(4(acetyloxy)phenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
cyclohexyl4(4acetyloxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC25H29NO5c11522(25(29)31187435818)23(2420(2615)961021(24)28)17111319(141217)3016(2)27h1114182326H310H212H3
MFCD00752926
ZINC000000677299
ZINC000000677302
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