CHEBI:131538 - N-docosanoyl-14-methylhexadecasphingosine

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ChEBI Name N-docosanoyl-14-methylhexadecasphingosine
ChEBI ID CHEBI:131538
ChEBI ASCII Name N-docosanoyl-14-methylhexadecasphingosine
Definition A ceramide obtained by formal condensation of the carboxy group of docosanoic acid with the amino group of 14-methylhexadecasphingosine. It is a metabolite of the nematode Caenorhabditis elegans.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C39H77NO3
Net Charge 0
Average Mass 608.035
Monoisotopic Mass 607.59035
InChI InChI=1S/C39H77NO3/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-28-31-34-39(43)40-37(35-41)38(42)33-30-27-24-22-21-23-26-29-32-36(3)5-2/h30,33,36-38,41-42H,4-29,31-32,34-35H2,1-3H3,(H,40,43)/b33-30+/t36?,37-,38+/m0/s1
InChIKey WHOQLMXMWKNQQT-RLKRFJBVSA-N
SMILES C(CCCCCC(CC)C)CC\C=C\[C@@H](O)[C@@H](NC(CCCCCCCCCCCCCCCCCCCCC)=O)CO
Metabolite of Species Details
Caenorhabditis elegans (NCBI:txid6239) See: PubMed
Roles Classification
Biological Role(s): Caenorhabditis elegans metabolite
A nematode metabolite produced by Caenorhabditis elegans.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing N-docosanoyl-14-methylhexadecasphingosine (CHEBI:131538) has functional parent 14-methylhexadecasphingosine (CHEBI:83988)
N-docosanoyl-14-methylhexadecasphingosine (CHEBI:131538) has functional parent docosanoic acid (CHEBI:28941)
N-docosanoyl-14-methylhexadecasphingosine (CHEBI:131538) has role Caenorhabditis elegans metabolite (CHEBI:78804)
N-docosanoyl-14-methylhexadecasphingosine (CHEBI:131538) is a ceramide (CHEBI:17761)
IUPAC Name
N-[(2S,3R,4E)-1,3-dihydroxy-14-methylhexadec-4-en-2-yl]docosanamide
Synonyms Sources
Cer (d17:1;3/22:0) ChEBI
Cer 39:1;3 ChEBI
N-docosanoyl-14-methylhexadecasphing-4-enine ChEBI
Citation Waiting for Citations Type Source
23894595 PubMed citation Europe PMC
Last Modified
15 March 2016