Vitas-M small molecule compound

methyl 3-(5,6,7-trihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)-3-(2,4,5-trimethoxyphenyl)propanoate

Catalog ID
STL544326
SMILES COC(=O)CC(c1c(O)c(O)c(c2c1oc(cc2=O)c1ccccc1)O)c1cc(OC)c(cc1OC)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 C28H26O10 MW 522.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26O10/c1-34-19-13-21(36-3)20(35-2)10-15(19)16(11-22(30)37-4)23-25(31)27(33)26(32)24-17(29)12-18(38-28(23)24)14-8-6-5-7-9-14/h5-10,12-13,16,31-33H,11H2,1-4H3
InChIKey
XJXIEABGQBHTMS-UHFFFAOYSA-N
Synonyms
1574338-72-9
1574338729
75491628
InChI=1SC28H26O10c134191321(363)20(352)1015(19)16(1122(30)374)2325(31)27(33)26(32)2417(29)1218(3828(23)24)148657914h5101213163133H11H214H3
methyl3(567trihydroxy4oxo2phenyl4Hchromen8yl)3(245trimethoxyphenyl)propanoate
methyl3(567trihydroxy4oxo2phenylchromen8yl)3(245trimethoxyphenyl)propanoate
MFCD28052369
ZINC000096221655
ZINC000096221656

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Available files

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