Dataset

Piperine

This MassBank record with Accession MSBNK-RIKEN-PR301810 contains the MS2 mass spectrum of Piperine with the InChIkey MXXWOMGUGJBKIW-YPCIICBESA-N.

Chemical Info

molecular Image
InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+
SMILES O=C(\C=C\C=C\C1=CC2=C(OCO2)C=C1)N1CCCCC1
InChI Key MXXWOMGUGJBKIW-YPCIICBESA-N
Molecular Formula C17H19NO3
Exact Mass 285.343 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-PR301810
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T20:42:31.587262
MetadataModified 2024-01-11T20:42:31.756125
MetadataPublished 2019-03-28
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
C03882 KEGG Ligand
CHEMBL43185 ChEMBL
531025 eMolecules
45695 Brenda
DB12582 DrugBank
MTBLC28821 Metabolights
20806 Brenda
28821 ChEBI
piperine DailyMed
CB61323379 ChemicalBook
CB1249813 ChemicalBook
28821 Rhea
HMDB0029377 Human Metabolome Database
50148573 BindingDB
PIPERINE DailyMed
PIPERINE rxnorm
AYR PDBe
ZINC000001529772 ZINC
HY-N0144 MedChemExpress
LSM-42991 LINCS
DTXSID3021805 EPA CompTox Dashboard
PIPERINE clinicaltrials
638024 PubChem
PD001540 ProbesDrugs
U71XL721QK FDA SRS
SCHEMBL94058 SureChEMBL
14775491 PubChem: Thomson Pharma
94-62-2 ACToR
7780-20-3 ACToR
Piperine(1-Piperoylpiperidine) Selleck
147030-08-8 ACToR
J50.666D Nikkaji
10016311 NMRShiftDB
2489 Guide to Pharmacology
PIPINE CCDC
J4.701E Nikkaji
MCULE-2161604269 Mcule
The data in this table is sourced from UniChem at EBI.