Dataset

Dihydroquercetin

This MassBank record with Accession MSBNK-Washington_State_Univ-BML01273 contains the MS2 mass spectrum of Dihydroquercetin with the InChIkey CXQWRCVTCMQVQX-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C15H12O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,14-19,21H
SMILES	C1=CC(=C(C=C1C2C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O
InChI Key	CXQWRCVTCMQVQX-UHFFFAOYSA-N
Molecular Formula	C15H12O7
Exact Mass	304.058 g/mol

Data and Resources

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Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-sa/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML01273
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T22:14:02.075152
MetadataModified	2025-02-09T20:03:55.660361
MetadataPublished	2016-01-19

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
496932	BindingDB
CB0213527	ChemicalBook
HMDB0242509	Human Metabolome Database
J2.227F	Nikkaji
110839	Brenda
CHEMBL337309	ChEMBL
38747	ChEBI
60026008	NMRShiftDB
14923085	PubChem: Thomson Pharma
480-18-2	ACToR
Taxifolin(Dihydroquercetin)	Selleck
PD014975	ProbesDrugs
729333	eMolecules
123517	Brenda
82122	Brenda
85302	Brenda
133005	Brenda
122986	Brenda
1502	Brenda
127320	Brenda
471	PubChem
MCULE-4254870575	Mcule
SCHEMBL39570	SureChEMBL
The data in this table is sourced from UniChem at EBI.