Vitas-M small molecule compound

methyl 3-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-oxo-4H-chromen-8-yl]-3-phenylpropanoate

Catalog ID
STL542591
SMILES COC(=O)CC(c1c(O)cc(c2c1oc(c1ccc(c(c1)O)O)c(c2=O)O)O)c1ccccc1

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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 C25H20O9 MW 464.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20O9/c1-33-19(30)10-14(12-5-3-2-4-6-12)20-17(28)11-18(29)21-22(31)23(32)24(34-25(20)21)13-7-8-15(26)16(27)9-13/h2-9,11,14,26-29,32H,10H2,1H3
InChIKey
ATENMZAKVUILJJ-UHFFFAOYSA-N
Synonyms
1574478-47-9
1574478479
71825717
InChI=1SC25H20O9c13319(30)1014(125324612)2017(28)1118(29)2122(31)23(32)24(3425(20)21)137815(26)16(27)913h291114262932H10H21H3
methyl3(2(34dihydroxyphenyl)357trihydroxy4oxo4Hchromen8yl)3phenylpropanoate
methyl3(2(34dihydroxyphenyl)357trihydroxy4oxochromen8yl)3phenylpropanoate
MFCD28051946
ZINC000096116260
ZINC000096116261

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Available files

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