EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:74179 - N-tricosanoyl-15-methylhexadecasphinganine

ChEBI IDCHEBI:74179
ChEBI NameN-tricosanoyl-15-methylhexadecasphinganine
Stars
ASCII NameN-tricosanoyl-15-methylhexadecasphinganine
DefinitionA N-acyl-15-methylhexadecasphinganine in which the acyl group has 23 carbons and 0 double bonds.
Last Modified15 March 2016
Submitterabridge
DownloadsMolfile
FormulaC40H81NO3
Net Charge0
Average Mass624.092
Monoisotopic Mass623.62165
SMILESCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@H](O)CCCCCCCCCCCC(C)C
InChIInChI=1S/C40H81NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-26-29-32-35-40(44)41-38(36-42)39(43)34-31-28-25-22-20-21-24-27-30-33-37(2)3/h37-39,42-43H,4-36H2,1-3H3,(H,41,44)/t38-,39+/m0/s1
InChIKeyGMSKHQKPCFUMOY-ZESVVUHVSA-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-tricosanoyl-15-methylhexadecasphinganine (CHEBI:74179) has role Caenorhabditis elegans metabolite (CHEBI:78804)
N-tricosanoyl-15-methylhexadecasphinganine (CHEBI:74179) is a N-acyl-15-methylhexadecasphinganine (CHEBI:70845)
IUPAC Name 
N-[(2S,3R)-1,3-dihydroxy-15-methylhexadecan-2-yl]tricosanamide
Synonyms  Source
N-tricosanoyl-15-methylhexadecadihydrosphingosineSUBMITTER
Cer (d17:0;2/23:0)ChEBI
Cer 40:0;2ChEBI
Citations