Dataset

Myristic acid

This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_N106626_9CB7 contains the MS2 mass spectrum of Myristic acid with the InChIkey TUNFSRHWOTWDNC-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16)
SMILES CCCCCCCCCCCCCC(=O)O
InChI Key TUNFSRHWOTWDNC-UHFFFAOYSA-N
Molecular Formula C14H28O2
Exact Mass 228.209 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_N106626_9CB7
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:37:03.143169
MetadataModified 2025-02-08T18:46:58.943752
MetadataPublished 2022-04-09
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
DB08231 DrugBank
C06424 KEGG Ligand
CHEMBL111077 ChEMBL
28875 ChEBI
MYR PDBe
ZZZOEG CCDC
HY-N2041 MedChemExpress
J4.411C Nikkaji
2806 Guide to Pharmacology
ZINC000001530417 ZINC
LMFA01010014 LipidMaps
50147581 BindingDB
30197 Brenda
DTXSID6021666 EPA CompTox Dashboard
MYRISTIC ACID rxnorm
MYRISTIC ACID clinicaltrials
11005 PubChem
14892448 PubChem: Thomson Pharma
PD004622 ProbesDrugs
45184-05-2 ACToR
67701-02-4 ACToR
544-63-8 ACToR
0I3V7S25AW FDA SRS
480439 eMolecules
60016322 NMRShiftDB
4284 Brenda
876 Brenda
MTBLC28875 Metabolights
137288 Brenda
HMDB0000806 Human Metabolome Database
4568 Brenda
CB1104862 ChemicalBook
2414 Brenda
SCHEMBL6374 SureChEMBL
MCULE-9671122893 Mcule
The data in this table is sourced from UniChem at EBI.