Vitas-M small molecule compound
2-hydroxy-3-[(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)acetyl]-6-methyl-4H-pyran-4-one
Catalog ID
STL528073
SMILES COc1c2c(CCN(C2CC(=O)c2c(O)oc(cc2=O)C)C)cc2c1OCO2
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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 C20H21NO7 MW 387.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO7/c1-10-6-13(22)17(20(24)28-10)14(23)8-12-16-11(4-5-21(12)2)7-15-18(19(16)25-3)27-9-26-15/h6-7,12,24H,4-5,8-9H2,1-3H3InChIKey
FWJDQPWXJGZLCO-UHFFFAOYSA-NSynonyms
2hydroxy3((4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)acetyl)6methyl4Hpyran4one
2hydroxy3(2(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)acetyl)6methyl4Hpyran4one
InChI=1SC20H21NO7c110613(22)17(20(24)2810)14(23)8121611(4521(12)2)71518(19(16)253)2792615h671224H4589H213H3
MFCD02115761
ZINC000002146391
ZINC000002146392
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