Vitas-M small molecule compound

methyl 3-(4-hydroxy-2-oxo-2H-chromen-3-yl)-3-(7-methoxy-1,3-benzodioxol-5-yl)propanoate

Catalog ID
STL545024
SMILES COC(=O)CC(c1c(=O)oc2c(c1O)cccc2)c1cc(OC)c2c(c1)OCO2

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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 C21H18O8 MW 398.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18O8/c1-25-15-7-11(8-16-20(15)28-10-27-16)13(9-17(22)26-2)18-19(23)12-5-3-4-6-14(12)29-21(18)24/h3-8,13,23H,9-10H2,1-2H3
InChIKey
FLCSWJLQESMLFM-UHFFFAOYSA-N
Synonyms
1630872-57-9
methyl3(4hydroxy2oxo2Hchromen3yl)3(7methoxy13benzodioxol5yl)propanoate
METHYL3(4HYDROXY2OXO2HCHROMEN3YL)3(7METHOXYBENZO(D)(13)DIOXOL5YL)PROPANOATE
methyl3(4hydroxy2oxochromen3yl)3(7methoxy13benzodioxol5yl)propanoate
Registry IDs
MFCD28349790
ZINC000217845114
ZINC000217845187

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Available files

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