Dataset

Hordenine

This MassBank record with Accession MSBNK-RIKEN-PR300516 contains the MS2 mass spectrum of Hordenine with the InChIkey KUBCEEMXQZUPDQ-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H15NO/c1-11(2)8-7-9-3-5-10(12)6-4-9/h3-6,12H,7-8H2,1-2H3
SMILES CN(C)CCC1=CC=C(O)C=C1
InChI Key KUBCEEMXQZUPDQ-UHFFFAOYSA-N
Molecular Formula C10H15NO
Exact Mass 165.236 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-PR300516
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T19:42:38.032188
MetadataModified 2025-02-09T18:28:24.111439
MetadataPublished 2019-03-28
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CB4747471 ChemicalBook
CB21261198 ChemicalBook
HMDB0004366 Human Metabolome Database
MTBLC5764 Metabolights
SCHEMBL36798 SureChEMBL
MCULE-5733361719 Mcule
68313 PubChem
60015803 NMRShiftDB
PD010732 ProbesDrugs
15091285 PubChem: Thomson Pharma
539-15-1 ACToR
Hordenine Selleck
K3489CA082 FDA SRS
873168 eMolecules
C06199 KEGG Ligand
5764 ChEBI
CHEMBL505789 ChEMBL
HY-N0113 MedChemExpress
HORDENINE rxnorm
ZINC000000160784 ZINC
TALJIZ CCDC
J6.381I Nikkaji
DTXSID2046096 EPA CompTox Dashboard
The data in this table is sourced from UniChem at EBI.