Vitas-M small molecule compound
(2E,4E)-1-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)-4-methyl-5-phenylpenta-2,4-dien-1-one
Catalog ID
STL513537
SMILES COc1c2CN(C)CCc2c(c2c1OCO2)C(=O)/C=C/C(=C/c1ccccc1)/C
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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 C24H25NO4 MW 391.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25NO4/c1-16(13-17-7-5-4-6-8-17)9-10-20(26)21-18-11-12-25(2)14-19(18)22(27-3)24-23(21)28-15-29-24/h4-10,13H,11-12,14-15H2,1-3H3/b10-9+,16-13+InChIKey
HGKBUFQLERZSEX-FVTBZGPOSA-NSynonyms
370584-71-7(2~(E)4~(E))1(4methoxy6methyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin9yl)4methyl5phenylpenta24dien1one
(2E4E)1(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)4methyl5phenylpenta24dien1one
(2E4E)1(4METHOXY6METHYL78DIHYDRO5H(13)DIOXOLO(45G)ISOQUINOLIN9YL)4METHYL5PHENYLPENTA24DIEN1ONE
370584717
5914320
COc1c2CN(C)CCc2c(c2c1OCO2)C(=O)C=CC(=Cc1ccccc1)C
InChI=1SC24H25NO4c116(13177546817)91020(26)2118111225(2)1419(18)22(273)2423(21)28152924h41013H11121415H213H3b109+1613+
MFCD03006227
ZINC000020112816
ZINC20112816
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