Vitas-M small molecule compound

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

Catalog ID
STL541812
SMILES COC(=O)CC(c1c(O)cc(c2c1oc(c1ccc(c(c1)O)O)c(c2=O)O)O)c1ccc(cc1)OC

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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 C26H22O10 MW 494.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22O10/c1-34-14-6-3-12(4-7-14)15(10-20(31)35-2)21-18(29)11-19(30)22-23(32)24(33)25(36-26(21)22)13-5-8-16(27)17(28)9-13/h3-9,11,15,27-30,33H,10H2,1-2H3
InChIKey
VTHICKYRHKXNAT-UHFFFAOYSA-N
Synonyms
1574483-41-2
1574483412
71826939
InChI=1SC26H22O10c134146312(4714)15(1020(31)352)2118(29)1119(30)2223(32)24(33)25(3626(21)22)135816(27)17(28)913h391115273033H10H212H3
methyl3(2(34dihydroxyphenyl)357trihydroxy4oxo4Hchromen8yl)3(4methoxyphenyl)propanoate
methyl3(2(34dihydroxyphenyl)357trihydroxy4oxochromen8yl)3(4methoxyphenyl)propanoate
MFCD28050958
ZINC000096114417
ZINC000096114418

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Available files

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