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CHEBI:71375 - N-henicosanoyl-15-methylhexadecasphing-4-enine

ChEBI IDCHEBI:71375
ChEBI NameN-henicosanoyl-15-methylhexadecasphing-4-enine
Stars
ASCII NameN-henicosanoyl-15-methylhexadecasphing-4-enine
DefinitionAn N-acyl-15-methylhexadecasphing-4-enine in which the acyl group has 21 carbons and 0 double bonds.
Last Modified29 June 2017
SubmitterAlan Bridge
DownloadsMolfile
FormulaC38H75NO3
Net Charge0
Average Mass594.022
Monoisotopic Mass593.57470
SMILESCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@H](O)/C=C/CCCCCCCCCC(C)C
InChIInChI=1S/C38H75NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-24-27-30-33-38(42)39-36(34-40)37(41)32-29-26-23-20-18-19-22-25-28-31-35(2)3/h29,32,35-37,40-41H,4-28,30-31,33-34H2,1-3H3,(H,39,42)/b32-29+/t36-,37+/m0/s1
InChIKeyXTOGDASSFFGCNZ-DXPOGGQJSA-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-henicosanoyl-15-methylhexadecasphing-4-enine (CHEBI:71375) has functional parent 15-methylhexadecasphing-4-enine (CHEBI:70798)
N-henicosanoyl-15-methylhexadecasphing-4-enine (CHEBI:71375) has functional parent henicosanoic acid (CHEBI:39248)
N-henicosanoyl-15-methylhexadecasphing-4-enine (CHEBI:71375) has role Caenorhabditis elegans metabolite (CHEBI:78804)
N-henicosanoyl-15-methylhexadecasphing-4-enine (CHEBI:71375) is a N-acyl-15-methylhexadecasphing-4-enine (CHEBI:70846)
N-henicosanoyl-15-methylhexadecasphing-4-enine (CHEBI:71375) is a Cer(d38:1) (CHEBI:137570)
IUPAC Name 
N-[(2S,3R,4E)-1,3-dihydroxy-15-methylhexadec-4-en-2-yl]henicosanamide
Synonyms  Source
N-heneicosanoyl-15-methylhexadecasphing-4-enineChEBI
Cer (d17:1;2/21:0)ChEBI
Cer 38:1;2ChEBI
Citations