Dataset

5,7-Dimethoxy-4'-hydroxyflavanone

This MassBank record with Accession MSBNK-BS-BS003744 contains the MS mass spectrum of 5,7-Dimethoxy-4'-hydroxyflavanone with the InChIkey REBBZOCNEVVAPX-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C17H16O5/c1-20-12-7-15(21-2)17-13(19)9-14(22-16(17)8-12)10-3-5-11(18)6-4-10/h3-8,14,18H,9H2,1-2H3
SMILES O=C1C=2C(OC(C=3C(=C(C(O[H])=C(C3[H])[H])[H])[H])(C1([H])[H])[H])=C(C(OC([H])([H])[H])=C(C2OC([H])([H])[H])[H])[H]
InChI Key REBBZOCNEVVAPX-UHFFFAOYSA-N
Molecular Formula C17H16O5
Exact Mass 300.100 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-BS003744
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:36:09.336614
MetadataModified 2024-01-11T12:36:09.504315
MetadataPublished 2017-12-01
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
5271551 PubChem
LMPK12140595 LipidMaps
DTXSID40414920 EPA CompTox Dashboard
MCULE-8068976578 Mcule
4368305 eMolecules
60057383 NMRShiftDB
92389408 PubChem: Thomson Pharma
SCHEMBL5085603 SureChEMBL
CHEMBL2299039 ChEMBL
50488657 BindingDB
J2.848.569G Nikkaji
The data in this table is sourced from UniChem at EBI.