Vitas-M small molecule compound

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

Catalog ID
STL562526
SMILES COc1c2c(CCN(C2CC(c2ccccc2)OC(=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 C22H25NO5 MW 383.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25NO5/c1-14(24)28-18(15-7-5-4-6-8-15)12-17-20-16(9-10-23(17)2)11-19-21(22(20)25-3)27-13-26-19/h4-8,11,17-18H,9-10,12-13H2,1-3H3
InChIKey
HOJWQTIDNXZUOL-UHFFFAOYSA-N
Synonyms
4311-36-8
(2(4methoxy6methyl78dihydro5H(13)dioxolo(45g)isoquinolin5yl)1phenylethyl)acetate
2(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)1phenylethylacetate
3743220
4311368
InChI=1SC22H25NO5c114(24)2818(157546815)12172016(91023(17)2)111921(22(20)253)27132619h48111718H9101213H213H3
MFCD03006356
ZINC000002087396
ZINC000004029530

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Available files

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