Vitas-M small molecule compound

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

Catalog ID
STL539248
SMILES COC(=O)CC(c1c(O)cc(c2c1oc(cc2=O)c1ccccc1)O)c1cc(OC)c(c(c1)OC)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 C28H26O9 MW 506.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26O9/c1-33-22-10-16(11-23(34-2)27(22)36-4)17(12-24(32)35-3)25-18(29)13-19(30)26-20(31)14-21(37-28(25)26)15-8-6-5-7-9-15/h5-11,13-14,17,29-30H,12H2,1-4H3
InChIKey
BLPWODGCKVNVOC-UHFFFAOYSA-N
Synonyms
1574477-90-9
1574477909
71827065
InChI=1SC28H26O9c133221016(1123(342)27(22)364)17(1224(32)353)2518(29)1319(30)2620(31)1421(3728(25)26)158657915h5111314172930H12H214H3
methyl3(57dihydroxy4oxo2phenyl4Hchromen8yl)3(345trimethoxyphenyl)propanoate
methyl3(57dihydroxy4oxo2phenylchromen8yl)3(345trimethoxyphenyl)propanoate
MFCD28050852
ZINC000096114234
ZINC000096114235

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Available files

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