Dataset

3,4,5-Trihydroxystilbene

This MassBank record with Accession MSBNK-RIKEN-PR306261 contains the MS2 mass spectrum of 3,4,5-Trihydroxystilbene with the InChIkey LUKBXSAWLPMMSZ-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H
SMILES OC1=CC=C(C=CC2=CC(O)=CC(O)=C2)C=C1
InChI Key LUKBXSAWLPMMSZ-UHFFFAOYSA-N
Molecular Formula C14H12O3
Exact Mass 228.247 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-PR306261
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T20:41:57.045187
MetadataModified 2024-01-11T20:41:57.201035
MetadataPublished 2019-03-28
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
DTXSID10859420 EPA CompTox Dashboard
MTBLC27881 Metabolights
HMDB0246741 Human Metabolome Database
MUXBIT CCDC
MCULE-4334386251 Mcule
PD055726 ProbesDrugs
CHEMBL2019155 ChEMBL
LSM-2557 LINCS
5056 PubChem
27881 ChEBI
499475 eMolecules
The data in this table is sourced from UniChem at EBI.