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CHEBI:131541 - N-hexadecanoyl-14-methylhexadecasphingosine

ChEBI IDCHEBI:131541
ChEBI NameN-hexadecanoyl-14-methylhexadecasphingosine
Stars
ASCII NameN-hexadecanoyl-14-methylhexadecasphingosine
DefinitionA ceramide obtained by formal condensation of the carboxy group of hexadecanoic acid with the amino group of 14-methylhexadecasphingosine. It is a metabolite of the nematode Caenorhabditis elegans.
Last Modified15 March 2016
SubmitterSteve
DownloadsMolfile
FormulaC33H65NO3
Net Charge0
Average Mass523.887
Monoisotopic Mass523.49644
SMILESCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@H](O)/C=C/CCCCCCCCC(C)CC
InChIInChI=1S/C33H65NO3/c1-4-6-7-8-9-10-11-12-13-14-19-22-25-28-33(37)34-31(29-35)32(36)27-24-21-18-16-15-17-20-23-26-30(3)5-2/h24,27,30-32,35-36H,4-23,25-26,28-29H2,1-3H3,(H,34,37)/b27-24+/t30?,31-,32+/m0/s1
InChIKeyDETAYNXMLFLQSA-QLQMESJUSA-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-hexadecanoyl-14-methylhexadecasphingosine (CHEBI:131541) has functional parent 14-methylhexadecasphingosine (CHEBI:83988)
N-hexadecanoyl-14-methylhexadecasphingosine (CHEBI:131541) has functional parent hexadecanoic acid (CHEBI:15756)
N-hexadecanoyl-14-methylhexadecasphingosine (CHEBI:131541) has role Caenorhabditis elegans metabolite (CHEBI:78804)
N-hexadecanoyl-14-methylhexadecasphingosine (CHEBI:131541) is a ceramide (CHEBI:17761)
IUPAC Name 
N-[(2S,3R,4E)-1,3-dihydroxy-14-methylhexadec-4-en-2-yl]hexadecanamide
Synonyms  Source
N-hexadecanoyl-14-methylhexadecasphing-4-enineChEBI
Cer (d17:1;3/16:0)ChEBI
Cer 33:1;3ChEBI
Citations