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CHEBI:60417 - Man-β1-6-Ins-1-P-Cer(d20:0/26:0)

ChEBI IDCHEBI:60417
ChEBI NameMan-β1-6-Ins-1-P-Cer(d20:0/26:0)
Stars
ASCII NameMan-beta1-6-Ins-1-P-Cer(d20:0/26:0)
DefinitionA mannosylated ceramide phosphoinositol compound having a hexacosanoyl 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
FormulaC58H114NO16P
Net Charge0
Average Mass1112.515
Monoisotopic Mass1111.78752
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCC(=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)CCCCCCCCCCCCCCCCC
InChIInChI=1S/C58H114NO16P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-28-30-32-34-36-38-40-42-48(62)59-45(46(61)41-39-37-35-33-31-29-27-18-16-14-12-10-8-6-4-2)44-72-76(70,71)75-57-54(68)52(66)51(65)53(67)56(57)74-58-55(69)50(64)49(63)47(43-60)73-58/h45-47,49-58,60-61,63-69H,3-44H2,1-2H3,(H,59,62)(H,70,71)/t45-,46+,47+,49+,50-,51+,52+,53-,54+,55-,56+,57+,58-/m0/s1
InChIKeyXGYQPQQQKFLIET-PIGUMLMHSA-N
ChEBI Ontology
Outgoing Relation(s)
Man-β1-6-Ins-1-P-Cer(d20:0/26:0) (CHEBI:60417) has functional parent Ins-1-P-Cer(d18:0/26:0) (CHEBI:60405)
Man-β1-6-Ins-1-P-Cer(d20:0/26:0) (CHEBI:60417) is a Man-1-6-Ins-1-P-Cer(d20:0) (CHEBI:139444)
Incoming Relation(s)
Ins-1-P-6-Man-β1-6-Ins-1-P-Cer(d20:0/26:0) (CHEBI:60440) has functional parent Man-β1-6-Ins-1-P-Cer(d20:0/26:0) (CHEBI:60417)
IUPAC Names 
(2S,3R)-2-(hexacosanoylamino)-3-hydroxyicosyl (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,3R)-2-(hexacosanoylamino)-3-hydroxyicosyl hydrogen phosphate]
Synonyms  Source
MIPC-A (C26)SUBMITTER
MIPC-1 (C26)SUBMITTER
mannosylinositol phosphorylceramide A (C26)ChEBI
mannosylinositol phosphorylceramide A (20:0/26:0)ChEBI
Citations