Vitas-M small molecule compound

methyl 3-(2,4-dihydroxy-6-methylpyridin-3-yl)-3-(8-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)propanoate

Catalog ID
STL246229
SMILES COC(=O)CC(c1c(O)cc(nc1O)C)c1cc(OC)c2c(c1)OCCO2

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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 C19H21NO7 MW 375.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO7/c1-10-6-13(21)17(19(23)20-10)12(9-16(22)25-3)11-7-14(24-2)18-15(8-11)26-4-5-27-18/h6-8,12H,4-5,9H2,1-3H3,(H2,20,21,23)
InChIKey
GJFHCWQXSNICPW-UHFFFAOYSA-N
Synonyms
1374544-63-4
1374544634
CC1=CC(=C(C(=O)N1)C(CC(=O)OC)C2=CC3=C(C(=C2)OC)OCCO3)O
InChI=1SC19H21NO7c110613(21)17(19(23)2010)12(916(22)253)11714(242)1815(811)26452718h6812H459H213H3(H2202123)
methyl3(24dihydroxy6methylpyridin3yl)3(8methoxy23dihydro14benzodioxin6yl)propanoate
methyl3(4hydroxy6methyl2oxo1Hpyridin3yl)3(5methoxy23dihydro14benzodioxin7yl)propanoate
MFCD24860501
ZINC000072404877
ZINC000072404878

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Available files

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