Dataset

[6]-Gingerol

This MassBank record with Accession MSBNK-RIKEN-PR307281 contains the MS2 mass spectrum of [6]-Gingerol with the InChIkey NLDDIKRKFXEWBK-AWEZNQCLSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C17H26O4/c1-3-4-5-6-14(18)12-15(19)9-7-13-8-10-16(20)17(11-13)21-2/h8,10-11,14,18,20H,3-7,9,12H2,1-2H3/t14-/m0/s1
SMILES CCCCC[C@@H](CC(=O)CCC1=CC(=C(C=C1)O)OC)O
InChI Key NLDDIKRKFXEWBK-AWEZNQCLSA-N
Molecular Formula C17H26O4
Exact Mass 294.183 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-PR307281
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T20:35:53.998964
MetadataModified 2025-02-09T18:31:55.162430
MetadataPublished 2019-03-28
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
63483 Brenda
MTBLC10136 Metabolights
210595 Brenda
CB4328683 ChemicalBook
189572 Brenda
SCHEMBL32102 SureChEMBL
10136 ChEBI
442793 PubChem
60022506 NMRShiftDB
LMPK15020007 LipidMaps
16813919 PubChem: Thomson Pharma
925QK2Z900 FDA SRS
LSM-2569 LINCS
23513-14-6 ACToR
PD015674 ProbesDrugs
1934620 eMolecules
HY-14615 MedChemExpress
2428 Guide to Pharmacology
DTXSID3041035 EPA CompTox Dashboard
ZINC000001531846 ZINC
J46.683B Nikkaji
C10462 KEGG Ligand
CHEMBL402978 ChEMBL
The data in this table is sourced from UniChem at EBI.