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CHEBI:62709 - Man-1-6-Ins-1-P-Cer(t20:0/24:0)

ChEBI IDCHEBI:62709
ChEBI NameMan-1-6-Ins-1-P-Cer(t20:0/24:0)
Stars
DefinitionA mannosylinositol phosphorylceramide compound having a tetracosanoyl group amide-linked to a C20 phytosphingosine base, with no hydroxylation of the C24 very long chain fatty acid.
Last Modified18 January 2021
Submitterbheavner
DownloadsMolfile
FormulaC56H110NO17P
Net Charge0
Average Mass1100.460
Monoisotopic Mass1099.75114
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]1OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)[C@H](O)C(O)CCCCCCCCCCCCCCCC
InChIInChI=1S/C56H110NO17P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-27-29-31-33-35-37-39-45(60)57-42(46(61)43(59)38-36-34-32-30-28-26-18-16-14-12-10-8-6-4-2)41-71-75(69,70)74-55-52(67)50(65)49(64)51(66)54(55)73-56-53(68)48(63)47(62)44(40-58)72-56/h42-44,46-56,58-59,61-68H,3-41H2,1-2H3,(H,57,60)(H,69,70)/t42-,43?,44+,46-,47+,48-,49+,50+,51-,52+,53-,54+,55+,56?/m0/s1
InChIKeyBMNKZXNVALZWPP-FVBHBDHUSA-N
ChEBI Ontology
Outgoing Relation(s)
Man-1-6-Ins-1-P-Cer(t20:0/24:0) (CHEBI:62709) has functional parent Ins-1-P-Cer(t20:0/24:0) (CHEBI:62699)
Man-1-6-Ins-1-P-Cer(t20:0/24:0) (CHEBI:62709) is a Man-1-6-Ins-1-P-Cer(t20:0) (CHEBI:139436)
Man-1-6-Ins-1-P-Cer(t20:0/24:0) (CHEBI:62709) is a mannosylinositol phosphophytoceramide (CHEBI:65000)
Incoming Relation(s)
Ins-1-P-6-Man-1-6-Ins-1-P-Cer(t20:0/24:0) (CHEBI:62718) has functional parent Man-1-6-Ins-1-P-Cer(t20:0/24:0) (CHEBI:62709)
IUPAC Names 
(2S,3S)-3,4-dihydroxy-2-(tetracosanoylamino)icosyl (1R,2R,3R,4R,5S,6R)-2,3,4,5-tetrahydroxy-6-(D-mannopyranosyloxy)cyclohexyl hydrogen phosphate
1D-6-O-(D-mannopyranosyl)-myo-inositol 1-[(2S,3S)-3,4-dihydroxy-2-(tetracosanoylamino)icosyl hydrogen phosphate]
Synonyms  Source
MIPC-BSUBMITTER
MIPC-2SUBMITTER
mannose-inositol-P-ceramide-BSUBMITTER