Vitas-M small molecule compound
6-methyl 3-[2-(propan-2-yloxy)ethyl] 4-(3-ethoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404897
SMILES CCOc1cccc(c1)C1C(=C(C)NC2=C1C(=O)C(C(C2)C)C(=O)OC)C(=O)OCCOC(C)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 C27H35NO7 MW 485.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35NO7/c1-7-33-19-10-8-9-18(14-19)23-22(27(31)35-12-11-34-15(2)3)17(5)28-20-13-16(4)21(26(30)32-6)25(29)24(20)23/h8-10,14-16,21,23,28H,7,11-13H2,1-6H3InChIKey
PQCMKGWGBJOIQN-UHFFFAOYSA-NSynonyms
6methyl3(2(propan2yloxy)ethyl)4(3ethoxyphenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
6Omethyl3O(2propan2yloxyethyl)4(3ethoxyphenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCOC1=CC=CC(=C1)C2C3=C(CC(C(C3=O)C(=O)OC)C)NC(=C2C(=O)OCCOC(C)C)C
InChI=1SC27H35NO7c173319108918(1419)2322(27(31)3512113415(2)3)17(5)28201316(4)21(26(30)326)25(29)24(20)23h8101416212328H71113H216H3
MFCD06194043
ZINC000004787536
ZINC000102010003
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