Vitas-M small molecule compound
2-phenoxyethyl 2-methyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK407241
SMILES COc1c(OC)cc(cc1OC)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCCOc1ccccc1
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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 C28H31NO7 MW 493.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO7/c1-17-24(28(31)36-14-13-35-19-9-6-5-7-10-19)25(26-20(29-17)11-8-12-21(26)30)18-15-22(32-2)27(34-4)23(16-18)33-3/h5-7,9-10,15-16,25,29H,8,11-14H2,1-4H3InChIKey
WINMTEVCQMSZNC-UHFFFAOYSA-NSynonyms
2phenoxyethyl2methyl5oxo4(345trimethoxyphenyl)145678hexahydroquinoline3carboxylate
2phenoxyethyl2methyl5oxo4(345trimethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C(=C3)OC)OC)OC)C(=O)OCCOC4=CC=CC=C4
InChI=1SC28H31NO7c11724(28(31)361413351996571019)25(2620(2917)1181221(26)30)181522(322)27(344)23(1618)333h5791015162529H81114H214H3
MFCD01306175
ZINC000002062531
ZINC000002062532
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