Dataset

Galangin

This MassBank record with Accession MSBNK-BS-BS003693 contains the MS mass spectrum of Galangin with the InChIkey VCCRNZQBSJXYJD-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H10O5/c16-9-6-10(17)12-11(7-9)20-15(14(19)13(12)18)8-4-2-1-3-5-8/h1-7,16-17,19H
SMILES C1(=C(C(=C(C(=C1[H])[H])C2=C(C(=O)C3=C(C(=C(C(=C3O2)[H])O[H])[H])O[H])O[H])[H])[H])[H]
InChI Key VCCRNZQBSJXYJD-UHFFFAOYSA-N
Molecular Formula C15H10O5
Exact Mass 270.053 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-BS003693
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:37:18.591193
MetadataModified 2025-02-09T08:49:43.312380
MetadataPublished 2017-12-01
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
5262 ChEBI
C10044 KEGG Ligand
410 Guide to Pharmacology
CHEMBL309490 ChEMBL
HY-N0382 MedChemExpress
MCULE-8693579543 Mcule
DTXSID70203288 EPA CompTox Dashboard
LMPK12111653 LipidMaps
50049391 BindingDB
J1.607A Nikkaji
HERYOW CCDC
ZINC000000120273 ZINC
60015864 NMRShiftDB
PD001197 ProbesDrugs
KMC PDBe
14799261 PubChem: Thomson Pharma
548-83-4 ACToR
142FWE6ECS FDA SRS
494438 eMolecules
CB8413460 ChemicalBook
MTBLC5262 Metabolights
125031 Brenda
2110 Brenda
HMDB0029521 Human Metabolome Database
156716 Brenda
5281616 PubChem
SCHEMBL117225 SureChEMBL
The data in this table is sourced from UniChem at EBI.