Vitas-M small molecule compound
methyl 2-methyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363767
SMILES COC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(cc1OC)OC)C(=O)CCC2
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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 C21H25NO6 MW 387.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO6/c1-11-18(21(24)28-5)19(20-13(22-11)7-6-8-14(20)23)12-9-16(26-3)17(27-4)10-15(12)25-2/h9-10,19,22H,6-8H2,1-5H3InChIKey
ISQFSVDCWYMJNY-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3OC)OC)OC)C(=O)OC
InChI=1SC21H25NO6c11118(21(24)285)19(2013(2211)76814(20)23)12916(263)17(274)1015(12)252h9101922H68H215H3
methyl2methyl5oxo4(245trimethoxyphenyl)145678hexahydroquinoline3carboxylate
methyl2methyl5oxo4(245trimethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
MFCD01814409
ZINC000019772560
ZINC000019772562
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