Triolein

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Systematic / IUPAC Name: 2,3-Bis[[(Z)-octadec-9-enoyl]oxy]propyl (Z)-octadec-9-enoate

ID: Reference13900

Other Names: Glycerol trioleate;
AA-4618

Formula: C57H104O6

Class: Endogenous Metabolites

Spectral Data

Triolein mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap ID-X with ETD_Cal Gateshead
No. of Spectral Trees 1
No. of Spectra 553
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 5/11/2026 9:24:01 AM
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Identificators

InChI InChI=1S/C57H104O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h25-30,54H,4-24,31-53H2,1-3H3/b28-25-,29-26-,30-27-
InChI Key PHYFQTYBJUILEZ-IUPFWZBJSA-N
Canonical SMILES CCCCCCCC/C=C\CCCCCCCC(=O)OCC(COC(=O)CCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCC/C=C\CCCCCCCC
CAS
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Other Names Glycerol trioleate;
AA-4618

In Other Databases

HMDb HMDB0005453
PubChem 5497163
ChEMBL CHEMBL4297656
Wikipedia Triolein
ChemSpider 4593733
LipidsMAPs LMGL03010250
DrugBank DB13038
ChEBI CHEBI:53753