Dataset

PALMITIC ACID

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP006253 contains the MS mass spectrum of PALMITIC ACID with the InChIkey IPCSVZSSVZVIGE-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)
SMILES CCCCCCCCCCCCCCCC(O)=O
InChI Key IPCSVZSSVZVIGE-UHFFFAOYSA-N
Molecular Formula C16H32O2
Exact Mass 256.240 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-Fac_Eng_Univ_Tokyo-JP006253
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T15:56:05.310890
MetadataModified 2024-01-11T15:56:05.484498
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
60018539 NMRShiftDB
PD007233 ProbesDrugs
palmitate Atlas
15196917 PubChem: Thomson Pharma
57-10-3 ACToR
116860-99-2 ACToR
2V16EO95H1 FDA SRS
MCULE-1361949901 Mcule
SCHEMBL6177 SureChEMBL
985 PubChem
YEFWEM CCDC
J1.378A Nikkaji
palmitic acid DailyMed
64992 Brenda
4529 Brenda
HMDB0000220 Human Metabolome Database
16189 Brenda
97712 Brenda
MTBLC15756 Metabolights
97710 Brenda
45639 Brenda
CB9388222 ChemicalBook
517 Brenda
30151 Brenda
535 Brenda
SCHEMBL20549353 SureChEMBL
135369651 PubChem
LMFA01010001 LipidMaps
DTXSID2021602 EPA CompTox Dashboard
HY-N0830 MedChemExpress
PALMITIC ACID clinicaltrials
PALMITIC ACID rxnorm
50152850 BindingDB
ZINC000006072466 ZINC
PALMITIC ACID DailyMed
CHEMBL82293 ChEMBL
DB03796 DrugBank
15756 ChEBI
PLM PDBe
1055 Guide to Pharmacology
C00249 KEGG Ligand
492637 eMolecules
26753504 eMolecules
The data in this table is sourced from UniChem at EBI.