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CHEBI:60416 - Man-β1-6-Ins-1-P-Cer(d18:0/24:0)

ChEBI IDCHEBI:60416
ChEBI NameMan-β1-6-Ins-1-P-Cer(d18:0/24:0)
Stars
ASCII NameMan-beta1-6-Ins-1-P-Cer(d18:0/24:0)
DefinitionA mannosylated ceramide phosphoinositol compound having a tetracosanoyl group attached to the ceramide nitrogen, with no hydroxylation at C-4 of the long-chain base or on the very-long-chain fatty acid.
Last Modified18 January 2021
Submitterbheavner
DownloadsMolfile
FormulaC54H106NO16P
Net Charge0
Average Mass1056.407
Monoisotopic Mass1055.72492
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]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)[C@H](O)CCCCCCCCCCCCCCC
InChIInChI=1S/C54H106NO16P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-44(58)55-41(42(57)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2)40-68-72(66,67)71-53-50(64)48(62)47(61)49(63)52(53)70-54-51(65)46(60)45(59)43(39-56)69-54/h41-43,45-54,56-57,59-65H,3-40H2,1-2H3,(H,55,58)(H,66,67)/t41-,42+,43+,45+,46-,47+,48+,49-,50+,51-,52+,53+,54-/m0/s1
InChIKeyGZIVPMFXRVKOKZ-YYMTZJTJSA-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)
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)
Man-β1-6-Ins-1-P-Cer(d18:0/24:0) (CHEBI:60416) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
Man-β1-6-Ins-1-P-Cer(d18:0/24:0) (CHEBI:60416) is a Man-1-6-Ins-1-P-Cer(d18:0) (CHEBI:139446)
Man-β1-6-Ins-1-P-Cer(d18:0/24:0) (CHEBI:60416) is conjugate acid of Man-β1-6-Ins-1-P-Cer(d18:0/24:0)(1−) (CHEBI:65156)
Incoming Relation(s)
Ins-1-P-6-Man-β1-6-Ins-1-P-Cer(d18:0/24:0) (CHEBI:60439) has functional parent Man-β1-6-Ins-1-P-Cer(d18:0/24:0) (CHEBI:60416)
Man-β1-6-Ins-1-P-Cer(d18:0/24:0)(1−) (CHEBI:65156) is conjugate base of Man-β1-6-Ins-1-P-Cer(d18:0/24:0) (CHEBI:60416)
IUPAC Names 
1D-6-O-(β-D-mannopyranosyl)-myo-inositol 1-[(2S,3R)-3-hydroxy-2-(tetracosanoylamino)octadecyl hydrogen phosphate]
(2S,3R)-3-hydroxy-2-(tetracosanoylamino)octadecyl (1R,2R,3R,4R,5S,6R)-2,3,4,5-tetrahydroxy-6-(β-D-mannopyranosyloxy)cyclohexyl hydrogen phosphate
Synonyms  Source
MIPC-A (C24)SUBMITTER
MIPC-1 (C24)SUBMITTER
mannosylinositol phosphorylceramide A (C24)ChEBI
mannosylinositol phosphorylceramide A (18:0/24:0)ChEBI
Citations