CHEBI:17314 - 13-hydroxydocosanoic acid

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ChEBI Name 13-hydroxydocosanoic acid
ChEBI ID CHEBI:17314
Definition A C22 hydroxy fatty acid with the hydroxy group at the 13-position and intermediate in the synthesis of sophorosyloxydocosanoate; a yeast glycolipid with potential medical and chemical engineering applications.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:750, CHEBI:19147
Supplier Information
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Formula C22H44O3
Net Charge 0
Average Mass 356.58296
Monoisotopic Mass 356.32905
InChI InChI=1S/C22H44O3/c1-2-3-4-5-9-12-15-18-21(23)19-16-13-10-7-6-8-11-14-17-20-22(24)25/h21,23H,2-20H2,1H3,(H,24,25)
InChIKey BYCZEMFWXYCUSJ-UHFFFAOYSA-N
SMILES CCCCCCCCCC(O)CCCCCCCCCCCC(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 13-hydroxydocosanoic acid (CHEBI:17314) has functional parent docosanoic acid (CHEBI:28941)
13-hydroxydocosanoic acid (CHEBI:17314) is a hydroxy fatty acid (CHEBI:24654)
13-hydroxydocosanoic acid (CHEBI:17314) is a long-chain fatty acid (CHEBI:15904)
13-hydroxydocosanoic acid (CHEBI:17314) is conjugate acid of 13-hydroxydocosanoate (CHEBI:11320)
Incoming 13-hydroxydocosanoate (CHEBI:11320) is conjugate base of 13-hydroxydocosanoic acid (CHEBI:17314)
IUPAC Name
13-hydroxydocosanoic acid
Synonyms Sources
13-Hydroxydocosanoate KEGG COMPOUND
13-Hydroxydocosanoic acid KEGG COMPOUND
HDA ChEBI
Manual Xrefs Databases
C03049 KEGG COMPOUND
LMFA01050210 LIPID MAPS
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Registry Numbers Types Sources
13980-16-0 CAS Registry Number ChemIDplus
1795554 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
422563 PubMed citation Europe PMC
5075510 PubMed citation Europe PMC
Last Modified
28 July 2014