Vitas-M small molecule compound
(3E)-4-(3,4-dimethoxyphenyl)-1-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)but-3-en-2-one
Catalog ID
STL562439
SMILES COc1cc(/C=C/C(=O)CC2N(C)CCc3c2c(OC)c2c(c3)OCO2)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 C24H27NO6 MW 425.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27NO6/c1-25-10-9-16-12-21-23(31-14-30-21)24(29-4)22(16)18(25)13-17(26)7-5-15-6-8-19(27-2)20(11-15)28-3/h5-8,11-12,18H,9-10,13-14H2,1-4H3/b7-5+InChIKey
WYNCIRMCPKRBFJ-FNORWQNLSA-NSynonyms
376380-79-9(3E)4(34dimethoxyphenyl)1(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)but3en2one
(E)4(34dimethoxyphenyl)1(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)but3en2one
(E)4(34dimethoxyphenyl)1(4methoxy6methyl78dihydro5H(13)dioxolo(45g)isoquinolin5yl)but3en2one
376380799
5797345
COc1cc(C=CC(=O)CC2N(C)CCc3c2c(OC)c2c(c3)OCO2)ccc1OC
InChI=1SC24H27NO6c12510916122123(31143021)24(294)22(16)18(25)1317(26)75156819(272)20(1115)283h58111218H9101314H214H3b75+
MFCD02115703
ZINC000020111947
ZINC000020111949
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