Vitas-M small molecule compound

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

Catalog ID
STL542832
SMILES COC(=O)CC(c1coc2c(c1=O)cccc2)c1c(O)cc(c2c1oc(c1ccc(c(c1)O)O)c(c2=O)O)O

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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 C28H20O11 MW 532.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20O11/c1-37-21(33)9-14(15-11-38-20-5-3-2-4-13(20)24(15)34)22-18(31)10-19(32)23-25(35)26(36)27(39-28(22)23)12-6-7-16(29)17(30)8-12/h2-8,10-11,14,29-32,36H,9H2,1H3
InChIKey
DBOOAVZEXFQNDE-UHFFFAOYSA-N
Synonyms
1574377-35-7
1574377357
75491948
InChI=1SC28H20O11c13721(33)914(15113820532413(20)24(15)34)2218(31)1019(32)2325(35)26(36)27(3928(22)23)126716(29)17(30)812h28101114293236H9H21H3
methyl3(2(34dihydroxyphenyl)357trihydroxy4oxo4Hchromen8yl)3(4oxo4Hchromen3yl)propanoate
methyl3(2(34dihydroxyphenyl)357trihydroxy4oxochromen8yl)3(4oxochromen3yl)propanoate
MFCD28052490
ZINC000108449897
ZINC000108449900

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Available files

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