Heneicosanoic acid

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Systematic / IUPAC Name:

ID: Reference13791

Other Names: Heneicosylic acid;
AA-3934

Formula: C21H42O2

Class: Endogenous Metabolites

Spectral Data

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

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Available MS Data

Used Instruments Orbitrap ID-X with ETD_Cal Gateshead
No. of Spectral Trees 1
No. of Spectra 455
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 3/2/2026 9:44:38 PM
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Identificators

InChI InChI=1S/C21H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23/h2-20H2,1H3,(H,22,23)
InChI Key CKDDRHZIAZRDBW-UHFFFAOYSA-N
Canonical SMILES CCCCCCCCCCCCCCCCCCCCC(=O)O
CAS
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Other Names Heneicosylic acid;
AA-3934

In Other Databases

HMDb HMDB0002345
Wikipedia Heneicosylic_acid
PubChem 16898
ChEMBL CHEMBL1172909
ChEBI CHEBI:39248
ChemSpider 16012