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CHEBI:60422 - Man-β1-6-Ins-1-P-Cer(t18:0/2-OH-24:0)

ChEBI IDCHEBI:60422
ChEBI NameMan-β1-6-Ins-1-P-Cer(t18:0/2-OH-24:0)
Stars
ASCII NameMan-beta1-6-Ins-1-P-Cer(t18:0/2-OH-24:0)
DefinitionA mannosylated ceramide phosphoinositol compound having a tetracosanoyl group attached to the ceramide nitrogen, hydroxylation at C-4 of the long-chain base, and hydroxylation at C-2 of the very-long-chain fatty acid.
Last Modified18 January 2021
Submitterbheavner
DownloadsMolfile
FormulaC54H106NO18P
Net Charge0
Average Mass1088.405
Monoisotopic Mass1087.71475
SMILESCCCCCCCCCCCCCCCCCCCCCCC(O)C(=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)C(O)CCCCCCCCCCCCCC
InChIInChI=1S/C54H106NO18P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-41(58)53(67)55-39(43(59)40(57)35-33-31-29-27-25-16-14-12-10-8-6-4-2)38-70-74(68,69)73-52-49(65)47(63)46(62)48(64)51(52)72-54-50(66)45(61)44(60)42(37-56)71-54/h39-52,54,56-66H,3-38H2,1-2H3,(H,55,67)(H,68,69)/t39-,40?,41?,42+,43-,44+,45-,46+,47+,48-,49+,50-,51+,52+,54-/m0/s1
InChIKeyHVXJHKJMUGDFHR-GYJUQVBOSA-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(t18:0/2-OH-24:0) (CHEBI:60422) has functional parent Ins-1-P-Cer(t18:0/2-OH-24:0) (CHEBI:60413)
Man-β1-6-Ins-1-P-Cer(t18:0/2-OH-24:0) (CHEBI:60422) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
Man-β1-6-Ins-1-P-Cer(t18:0/2-OH-24:0) (CHEBI:60422) is a mannosylinositol phosphophytoceramide (CHEBI:65000)
Man-β1-6-Ins-1-P-Cer(t18:0/2-OH-24:0) (CHEBI:60422) is conjugate acid of Man-β1-6-Ins-1-P-Cer(t18:0/2-OH-24:0)(1−) (CHEBI:65163)
Incoming Relation(s)
Ins-1-P-6-Man-β1-6-Ins-1-P-Cer(t18:0/2-OH-24:0) (CHEBI:60445) has functional parent Man-β1-6-Ins-1-P-Cer(t18:0/2-OH-24:0) (CHEBI:60422)
Man-β1-6-Ins-1-P-Cer(t18:0/2-OH-24:0)(1−) (CHEBI:65163) is conjugate base of Man-β1-6-Ins-1-P-Cer(t18:0/2-OH-24:0) (CHEBI:60422)
IUPAC Names 
(2S,3S)-3,4-dihydroxy-2-[(2-hydroxytetracosanoyl)amino]octadecyl (1R,2R,3R,4R,5S,6R)-2,3,4,5-tetrahydroxy-6-(β-D-mannopyranosyloxy)cyclohexyl hydrogen phosphate
1D-6-O-(β-D-mannopyranosyl)-myo-inositol 1-[(2S,3S)-3,4-dihydroxy-2-[(2-hydroxytetracosanoyl)amino]octadecyl hydrogen phosphate]
Synonyms  Source
MIPC-C (C24)SUBMITTER
MIPC-3 (C24)SUBMITTER
mannosylinositol phosphorylceramide C (C24)ChEBI
mannosylinositol phosphorylceramide C (18:0/24:0)ChEBI
Citations