Vitas-M small molecule compound
cycloheptyl 2-methyl-5-oxo-4-[4-(propan-2-yloxy)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK406519
SMILES CC(Oc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC1CCCCCC1)C
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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 C27H35NO4 MW 437.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35NO4/c1-17(2)31-21-15-13-19(14-16-21)25-24(27(30)32-20-9-6-4-5-7-10-20)18(3)28-22-11-8-12-23(29)26(22)25/h13-17,20,25,28H,4-12H2,1-3H3InChIKey
AHKWGLVSLPVSDA-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)OC(C)C)C(=O)OC4CCCCCC4
cycloheptyl2methyl5oxo4(4(propan2yloxy)phenyl)145678hexahydroquinoline3carboxylate
cycloheptyl2methyl5oxo4(4propan2yloxyphenyl)4678tetrahydro1Hquinoline3carboxylate
InChI=1SC27H35NO4c117(2)3121151319(141621)2524(27(30)3220964571020)18(3)28221181223(29)26(22)25h1317202528H412H213H3
MFCD06000555
ZINC000002868526
ZINC000002868527
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