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Formononetin-7-O-glucoside (Ononin)

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BS-BS003488

Dataset description:

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.

Source: Formononetin-7-O-glucoside (Ononin)

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

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Additional Information

Field	Value
Data last updated	January 11, 2024
Metadata last updated	January 11, 2024
Created	January 11, 2024
Format	HTML
License	Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0)
Id	568e08af-9191-4521-ab09-05f47b70de30
Package id	msbnk-bs-bs003488
Resource type	HTML
State	active