Dataset

Kaempferol-3-O-glucoside-2''-p-coumaroyl

This MassBank record with Accession MSBNK-RIKEN-PR306989 contains the MS2 mass spectrum of Kaempferol-3-O-glucoside-2''-p-coumaroyl with the InChIkey IKONEAPXVKTZFF-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C30H26O13/c31-13-21-24(37)26(39)29(42-22(36)10-3-14-1-6-16(32)7-2-14)30(41-21)43-28-25(38)23-19(35)11-18(34)12-20(23)40-27(28)15-4-8-17(33)9-5-15/h1-12,21,24,26,29-35,37,39H,13H2
SMILES OCC1OC(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C=C2)C(OC(=O)C=CC2=CC=C(O)C=C2)C(O)C1O
InChI Key IKONEAPXVKTZFF-UHFFFAOYSA-N
Molecular Formula C30H26O13
Exact Mass 594.525 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-RIKEN-PR306989
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T19:48:56.552666
MetadataModified 2025-02-09T18:26:32.879030
MetadataPublished 2019-03-28
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
71341515 PubChem
The data in this table is sourced from UniChem at EBI.