Dataset

Podocarpic acid

This MassBank record with Accession MSBNK-Washington_State_Univ-BML81986 contains the MS mass spectrum of Podocarpic acid with the InChIkey VJILEYKNALCDDV-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C17H22O3/c1-16-8-3-9-17(2,15(19)20)14(16)7-5-11-4-6-12(18)10-13(11)16/h4,6,10,14,18H,3,5,7-9H2,1-2H3,(H,19,20)
SMILES CC12CCCC(C1CCC3=C2C=C(C=C3)O)(C)C(=O)O
InChI Key VJILEYKNALCDDV-UHFFFAOYSA-N
Molecular Formula C17H22O3
Exact Mass 274.157 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-BML81986
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:23:48.144835
MetadataModified 2024-01-11T22:23:48.291846
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
60032950 NMRShiftDB
PD100221 ProbesDrugs
5947-49-9 ACToR
CHEMBL2220581 ChEMBL
MCULE-8369774775 Mcule
220357 PubChem
The data in this table is sourced from UniChem at EBI.