Vitas-M small molecule compound

(3Z)-4-hydroxy-5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)pent-3-en-2-one

Catalog ID
STL526625
SMILES COc1c2c(CCN(C2C/C(=C/C(=O)C)/O)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 C17H21NO5 MW 319.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21NO5/c1-10(19)6-12(20)8-13-15-11(4-5-18(13)2)7-14-16(17(15)21-3)23-9-22-14/h6-7,13,20H,4-5,8-9H2,1-3H3/b12-6-
InChIKey
OYQPPLXHBJXIDH-SDQBBNPISA-N
Synonyms
370583-35-0
(~(Z))4hydroxy5(4methoxy6methyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin5yl)pent3en2one
(3Z)4hydroxy5(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)pent3en2one
(Z)4hydroxy5(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)pent3en2one
(Z)4HYDROXY5(4METHOXY6METHYL78DIHYDRO5H(13)DIOXOLO(45G)ISOQUINOLIN5YL)PENT3EN2ONE
370583350
5913213
COc1c2c(CCN(C2CC(=CC(=O)C)O)C)cc2c1OCO2
InChI=1SC17H21NO5c110(19)612(20)8131511(4518(13)2)71416(17(15)213)2392214h671320H4589H213H3b126
MFCD03005875
ZINC000003984249
ZINC000100746268

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Available files

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