Dataset

6-Geranylnaringenin

This MassBank record with Accession MSBNK-BS-BS003216 contains the MS2 mass spectrum of 6-Geranylnaringenin with the InChIkey XYIQIBWIEGCVQY-FRKPEAEDSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C25H28O5/c1-15(2)5-4-6-16(3)7-12-19-20(27)13-23-24(25(19)29)21(28)14-22(30-23)17-8-10-18(26)11-9-17/h5,7-11,13,22,26-27,29H,4,6,12,14H2,1-3H3/b16-7+
SMILES CC(=CCC/C(=C/CC1=C(C=C2C(=C1O)C(=O)CC(O2)C3=CC=C(C=C3)O)O)/C)C
InChI Key XYIQIBWIEGCVQY-FRKPEAEDSA-N
Molecular Formula C25H28O5
Exact Mass 408.194 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-BS003216
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:35:06.521162
MetadataModified 2024-01-11T12:35:06.706217
MetadataPublished 2017-12-01
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
60049387 NMRShiftDB
SCHEMBL140804 SureChEMBL
14981240 PubChem: Thomson Pharma
10001495 PubChem
J1.132.706K Nikkaji
LMPK12140285 LipidMaps
J2.924.641F Nikkaji
412954 BindingDB
The data in this table is sourced from UniChem at EBI.