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CHEBI:131539 - N-heptadecanoyl-14-methylhexadecasphingosine

ChEBI IDCHEBI:131539
ChEBI NameN-heptadecanoyl-14-methylhexadecasphingosine
Stars
ASCII NameN-heptadecanoyl-14-methylhexadecasphingosine
DefinitionA ceramide obtained by formal condensation of the carboxy group of heptadecanoic acid with the amino group of 14-methylhexadecasphingosine. It is a metabolite of the nematode Caenorhabditis elegans.
Last Modified29 June 2017
SubmitterSteve
DownloadsMolfile
FormulaC34H67NO3
Net Charge0
Average Mass537.914
Monoisotopic Mass537.51210
SMILESCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@H](O)/C=C/CCCCCCCCC(C)CC
InChIInChI=1S/C34H67NO3/c1-4-6-7-8-9-10-11-12-13-14-15-20-23-26-29-34(38)35-32(30-36)33(37)28-25-22-19-17-16-18-21-24-27-31(3)5-2/h25,28,31-33,36-37H,4-24,26-27,29-30H2,1-3H3,(H,35,38)/b28-25+/t31?,32-,33+/m0/s1
InChIKeyNQJBRXDZDNXGGL-ZWTFWLHVSA-N
Species of MetaboliteComponentSourceComments
Caenorhabditis elegans (ncbitaxon:6239) - PubMed (23894595)
Roles Classification
Biological Role:
Caenorhabditis elegans metabolite  A nematode metabolite produced by Caenorhabditis elegans.
ChEBI Ontology
Outgoing Relation(s)
N-heptadecanoyl-14-methylhexadecasphingosine (CHEBI:131539) has functional parent 14-methylhexadecasphingosine (CHEBI:83988)
N-heptadecanoyl-14-methylhexadecasphingosine (CHEBI:131539) has functional parent heptadecanoic acid (CHEBI:32365)
N-heptadecanoyl-14-methylhexadecasphingosine (CHEBI:131539) has role Caenorhabditis elegans metabolite (CHEBI:78804)
N-heptadecanoyl-14-methylhexadecasphingosine (CHEBI:131539) is a Cer(d34:1) (CHEBI:137569)
N-heptadecanoyl-14-methylhexadecasphingosine (CHEBI:131539) is a ceramide (CHEBI:17761)
IUPAC Name 
N-[(2S,3R,4E)-1,3-dihydroxy-14-methylhexadec-4-en-2-yl]heptadecanamide
Synonyms  Source
Cer (d17:1;3/17:0)ChEBI
Cer 34:1;3ChEBI
N-heptadecanoyl-14-methylhexadecasphing-4-enineChEBI
Citations