Dataset

Nari-7-Glc, (S)-7-(beta-D-Glucopyranosyloxy)-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one, naringenin-7-O-glucoside, 4',5-Dihydroxy-7-glucosyloxyflavanone, Prunin, Naringenin 7-O-beta-D-glucoside

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS042802 contains the MS2 mass spectrum of Nari-7-Glc, (S)-7-(beta-D-Glucopyranosyloxy)-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one, naringenin-7-O-glucoside, 4',5-Dihydroxy-7-glucosyloxyflavanone, Prunin, Naringenin 7-O-beta-D-glucoside with the InChIkey DLIKSSGEMUFQOK-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C21H22O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-6,14,16,18-24,26-28H,7-8H2
SMILES	C1C(OC2=CC(=CC(=C2C1=O)O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC=C(C=C4)O
InChI Key	DLIKSSGEMUFQOK-UHFFFAOYSA-N
Molecular Formula	C21H22O10
Exact Mass	434.397 g/mol

Data and Resources

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Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-nc/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PS042802
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T21:32:20.427269
MetadataModified	2025-02-09T19:06:23.625053
MetadataPublished	2009-02-09

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
529-55-5	ACToR
SCHEMBL13625098	SureChEMBL
PD127307	ProbesDrugs
60021657	NMRShiftDB
282013	PubChem
HMDB0246916	Human Metabolome Database
The data in this table is sourced from UniChem at EBI.