Vitas-M small molecule compound
(2E)-3-(3,4-dimethoxyphenyl)-N-[(4-hydroxy-6-methyl-5-oxo-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)methyl]prop-2-enamide
Catalog ID
STL523375
SMILES COc1cc(/C=C/C(=O)NCc2c3OCOc3c(c3c2CCN(C3=O)C)O)ccc1OC
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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 C23H24N2O7 MW 440.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N2O7/c1-25-9-8-14-15(21-22(32-12-31-21)20(27)19(14)23(25)28)11-24-18(26)7-5-13-4-6-16(29-2)17(10-13)30-3/h4-7,10,27H,8-9,11-12H2,1-3H3,(H,24,26)/b7-5+InChIKey
FYNIWCQYRFOLHN-FNORWQNLSA-NSynonyms
(~(E))3(34dimethoxyphenyl)~(N)((4hydroxy6methyl5oxo78dihydro(13)dioxolo(45g)isoquinolin9yl)methyl)prop2enamide
(2E)3(34dimethoxyphenyl)N((4hydroxy6methyl5oxo5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)methyl)prop2enamide
(E)3(34dimethoxyphenyl)N((4hydroxy6methyl5oxo5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)methyl)acrylamide
127252702
COc1cc(C=CC(=O)NCc2c3OCOc3c(c3c2CCN(C3=O)C)O)ccc1OC
InChI=1SC23H24N2O7c125981415(2122(32123121)20(27)19(14)23(25)28)112418(26)75134616(292)17(1013)303h471027H891112H213H3(H2426)b75+
MFCD31752808
ZINC000604404380
ZINC604404380
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