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CHEBI:60402 - Ins-1-P-Cer(d18:0/24:0)

ChEBI IDCHEBI:60402
ChEBI NameIns-1-P-Cer(d18:0/24:0)
Stars
DefinitionA ceramide phosphoinositol compound having a tetracosanoyl group attached to the ceramide nitrogen.
Last Modified21 January 2016
Submitterbheavner
DownloadsMolfile
FormulaC48H96NO11P
Net Charge0
Average Mass894.266
Monoisotopic Mass893.67210
SMILESCCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](COP(=O)(O)O[C@@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CCCCCCCCCCCCCCC
InChIInChI=1S/C48H96NO11P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-42(51)49-40(41(50)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2)39-59-61(57,58)60-48-46(55)44(53)43(52)45(54)47(48)56/h40-41,43-48,50,52-56H,3-39H2,1-2H3,(H,49,51)(H,57,58)/t40-,41+,43-,44-,45+,46+,47+,48-/m0/s1
InChIKeySJUUDDANVVUTJD-LOTZUYGHSA-N
Species of MetaboliteComponentSourceComments
Saccharomyces cerevisiae (ncbitaxon:4932) - PubMed (24678285) Source: yeast.sf.net
Roles Classification
Biological Role:
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
ChEBI Ontology
Outgoing Relation(s)
Ins-1-P-Cer(d18:0/24:0) (CHEBI:60402) has functional parent N-tetracosanoylsphinganine (CHEBI:52961)
Ins-1-P-Cer(d18:0/24:0) (CHEBI:60402) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
Ins-1-P-Cer(d18:0/24:0) (CHEBI:60402) is a inositol phosphoceramide (CHEBI:60245)
Ins-1-P-Cer(d18:0/24:0) (CHEBI:60402) is conjugate acid of Ins-1-P-Cer(d18:0/24:0)(1−) (CHEBI:65091)
Incoming Relation(s)
Man-β1-6-Ins-1-P-Cer(d18:0/24:0) (CHEBI:60416) has functional parent Ins-1-P-Cer(d18:0/24:0) (CHEBI:60402)
Ins-1-P-Cer(d18:0/24:0)(1−) (CHEBI:65091) is conjugate base of Ins-1-P-Cer(d18:0/24:0) (CHEBI:60402)
IUPAC Names 
(2S,3R)-3-hydroxy-2-(tetracosanoylamino)octadecyl (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl hydrogen phosphate
(2S,3R)-3-hydroxy-2-(tetracosanoylamino)octadecyl 1D-myo-inositol hydrogen phosphate
Synonyms  Source
IPC-A (C24)SUBMITTER
IPC-1 (C24)SUBMITTER
inositol-P-ceramide-A (C24)ChEBI
inositol-P-ceramide-A (18:0/24:0)ChEBI
Citations