Dataset

Ginkgolide B

This MassBank record with Accession MSBNK-Washington_State_Univ-BML81295 contains the MS mass spectrum of Ginkgolide B with the InChIkey SQOJOAFXDQDRGF-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C20H24O10/c1-6-12(23)28-11-9(21)18-8-5-7(16(2,3)4)17(18)10(22)13(24)29-15(17)30-20(18,14(25)27-8)19(6,11)26/h6-11,15,21-22,26H,5H2,1-4H3
SMILES CC1C(=O)OC2C1(C34C(=O)OC5C3(C2O)C6(C(C5)C(C)(C)C)C(C(=O)OC6O4)O)O
InChI Key SQOJOAFXDQDRGF-UHFFFAOYSA-N
Molecular Formula C20H24O10
Exact Mass 424.137 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML81295
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:27:15.717565
MetadataModified 2024-01-11T22:27:15.870581
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
HMDB0036861 Human Metabolome Database
70113587 NMRShiftDB
65243 PubChem
PD056200 ProbesDrugs
SCHEMBL14279903 SureChEMBL
29549695 eMolecules
CHEMBL266625 ChEMBL
The data in this table is sourced from UniChem at EBI.