Vitas-M small molecule compound
methyl 4-(1,3-benzodioxol-5-yl)-7-methyl-2,5-dioxo-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate
Catalog ID
STK406443
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(CC(=O)N2)c1ccc2c(c1)OCO2
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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 C19H19NO6 MW 357.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19NO6/c1-9-5-12-17(18(22)16(9)19(23)24-2)11(7-15(21)20-12)10-3-4-13-14(6-10)26-8-25-13/h3-4,6,9,11,16H,5,7-8H2,1-2H3,(H,20,21)InChIKey
UXEIMEAPZOWINK-UHFFFAOYSA-NSynonyms
CC1CC2=C(C(CC(=O)N2)C3=CC4=C(C=C3)OCO4)C(=O)C1C(=O)OC
InChI=1SC19H19NO6c1951217(18(22)16(9)19(23)242)11(715(21)2012)10341314(610)2682513h34691116H578H212H3(H2021)
methyl4(13benzodioxol5yl)7methyl25dioxo12345678octahydroquinoline6carboxylate
methyl4(13benzodioxol5yl)7methyl25dioxo134678hexahydroquinoline6carboxylate
MFCD06759617
ZINC000013519181
ZINC000101348042
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