Vitas-M small molecule compound

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

Catalog ID
STL543787
SMILES COC(=O)CC(c1oc2ccccc2c(=O)c1O)c1ccc2c(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 C20H16O7 MW 368.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16O7/c1-24-17(21)9-13(11-6-7-15-16(8-11)26-10-25-15)20-19(23)18(22)12-4-2-3-5-14(12)27-20/h2-8,13,23H,9-10H2,1H3
InChIKey
BVIYZBBKJSERHC-UHFFFAOYSA-N
Synonyms

110207308
InChI=1SC20H16O7c12417(21)913(11671516(811)26102515)2019(23)18(22)12423514(12)2720h281323H910H21H3
methyl3(13benzodioxol5yl)3(3hydroxy4oxo4Hchromen2yl)propanoate
methyl3(13benzodioxol5yl)3(3hydroxy4oxochromen2yl)propanoate
METHYL3(BENZO(D)(13)DIOXOL5YL)3(3HYDROXY4OXO4HCHROMEN2YL)PROPANOATE
MFCD29056095
ZINC000253398033
ZINC000253398036

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Available files

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