Dataset

Flavanone + 4O, 1Prenyl

This MassBank record with Accession MSBNK-RIKEN-PR310773 contains the MS2 mass spectrum of Flavanone + 4O, 1Prenyl with the InChIkey MERHMOCEIBOOMA-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C20H20O6/c1-10(2)3-5-13-16(23)8-17(24)18-19(25)14(9-26-20(13)18)12-6-4-11(21)7-15(12)22/h3-4,6-8,14,21-24H,5,9H2,1-2H3
SMILES O=C1C3=C(O)C=C(O)C(=C3(OCC1C=2C=CC(O)=CC=2(O)))CC=C(C)C
InChI Key MERHMOCEIBOOMA-UHFFFAOYSA-N
Molecular Formula C20H20O6
Exact Mass 356.374 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-PR310773
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T20:42:21.176872
MetadataModified 2024-01-11T20:42:21.371781
MetadataPublished 2019-03-28
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
16832 ChEBI
C01590 KEGG Ligand
J17.657E Nikkaji
14977908 PubChem: Thomson Pharma
40105-60-0 ACToR
4231-70-3 ACToR
60048410 NMRShiftDB
SCHEMBL571650 SureChEMBL
104424 Brenda
119269 PubChem
HMDB0034213 Human Metabolome Database
16832 Rhea
MTBLC16832 Metabolights
91842 Brenda
12573 Brenda
LMPK12050479 LipidMaps
96V5H76C4P FDA SRS
The data in this table is sourced from UniChem at EBI.