Dataset

Formononetin-7-O-glucoside (Ononin)

This MassBank record with Accession MSBNK-BS-BS003488 contains the MS2 mass spectrum of Formononetin-7-O-glucoside (Ononin) with the InChIkey MGJLSBDCWOSMHL-MIUGBVLSSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C22H22O9/c1-28-12-4-2-11(3-5-12)15-10-29-16-8-13(6-7-14(16)18(15)24)30-22-21(27)20(26)19(25)17(9-23)31-22/h2-8,10,17,19-23,25-27H,9H2,1H3/t17-,19-,20+,21-,22-/m1/s1
SMILES COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O
InChI Key MGJLSBDCWOSMHL-MIUGBVLSSA-N
Molecular Formula C22H22O9
Exact Mass 430.126 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BS-BS003488
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:33:45.796859
MetadataModified 2024-01-11T12:33:45.946093
MetadataPublished 2017-12-01
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables