Vitas-M small molecule compound
3-cycloheptyl 6-methyl 4-(2-fluorophenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404429
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(C(=C(N2)C)C(=O)OC1CCCCCC1)c1ccccc1F
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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 C27H32FNO5 MW 469.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32FNO5/c1-15-14-20-24(25(30)21(15)26(31)33-3)23(18-12-8-9-13-19(18)28)22(16(2)29-20)27(32)34-17-10-6-4-5-7-11-17/h8-9,12-13,15,17,21,23,29H,4-7,10-11,14H2,1-3H3InChIKey
UCECTPQPSJGOAW-UHFFFAOYSA-NSynonyms
3cycloheptyl6methyl4(2fluorophenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3Ocycloheptyl6Omethyl4(2fluorophenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CC1CC2=C(C(C(=C(N2)C)C(=O)OC3CCCCCC3)C4=CC=CC=C4F)C(=O)C1C(=O)OC
InChI=1SC27H32FNO5c115142024(25(30)21(15)26(31)333)23(1812891319(18)28)22(16(2)2920)27(32)34171064571117h8912131517212329H47101114H213H3
MFCD04226205
ZINC000020569648
ZINC000102557852
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