Dataset

3'-Hydroxyflavone

This MassBank record with Accession MSBNK-BS-BS003773 contains the MS2 mass spectrum of 3'-Hydroxyflavone with the InChIkey ISZWRZGKEWQACU-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H10O3/c16-11-5-3-4-10(8-11)15-9-13(17)12-6-1-2-7-14(12)18-15/h1-9,16H
SMILES C1(=C(C(=C2C(=C1[H])C(=O)C(=C(O2)C3=C(C(=C(C(=C3[H])[H])[H])O[H])[H])[H])[H])[H])[H]
InChI Key ISZWRZGKEWQACU-UHFFFAOYSA-N
Molecular Formula C15H10O3
Exact Mass 238.063 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-BS003773
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:36:24.335933
MetadataModified 2024-01-11T12:36:24.512447
MetadataPublished 2017-12-01
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL147552 ChEMBL
4368504 eMolecules
229015 PubChem
165658 Brenda
ZINC000000057678 ZINC
DTXSID70281647 EPA CompTox Dashboard
50431165 BindingDB
PD001194 ProbesDrugs
SCHEMBL311580 SureChEMBL
70460-18-3 ACToR
20B PDBe
20234101 NMRShiftDB
MCULE-6532145595 Mcule
J705.725C Nikkaji
The data in this table is sourced from UniChem at EBI.