Vitas-M small molecule compound

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

Catalog ID
STL562390
SMILES COc1c2c(CCN(C2CC(=O)CCC=C(C)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 C20H27NO4 MW 345.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27NO4/c1-13(2)6-5-7-15(22)11-16-18-14(8-9-21(16)3)10-17-19(20(18)23-4)25-12-24-17/h6,10,16H,5,7-9,11-12H2,1-4H3
InChIKey
ZNKHGLPRSPFOGY-UHFFFAOYSA-N
Synonyms
376378-43-7
1(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)6methylhept5en2one
1(4methoxy6methyl78dihydro5H(13)dioxolo(45g)isoquinolin5yl)6methylhept5en2one
Registry IDs
MFCD02115458
ZINC000020111841
ZINC000020111842

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.