Dataset

1,2-Dipalmitoyl-rac-glycerol; LC-ESI-QTOF; MS2; CE: 40eV; R=7000; [M+CH3COO]-

This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_N103831_187B contains the MS2 mass spectrum of 1,2-Dipalmitoyl-rac-glycerol with the InChIkey JEJLGIQLPYYGEE-XIFFEERXSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C35H68O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(37)39-32-33(31-36)40-35(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33,36H,3-32H2,1-2H3/t33-/m0/s1
SMILES [H][C@](CO)(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC
InChI Key JEJLGIQLPYYGEE-XIFFEERXSA-N
Molecular Formula C35H68O5
Exact Mass 568.507 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_N103831_187B
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MetadataPublished 2022-04-09
Related Molecule
  • [(2S)-2-hexadecanoyloxy-3-hydroxypropyl] hexadecanoate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:82929 chebi
    LMGL02010009 lipidmaps
    Z41 rcsb_pdb
    CHEMBL87852 chembl
    594854 surechembl
    644078 pubchem
    PD019870 probes_and_drugs
    PALGLC CCDC
    233272 brenda
    46251 brenda
    SLM:000118523 swisslipids
    HMDB0007098 hmdb
    Molport-003-932-566 molport
    The data in this table is sourced from UniChem at EBI.