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CHEBI:60419 - Man-β1-6-Ins-1-P-Cer(d20:0/2-OH-26:0)

ChEBI IDCHEBI:60419
ChEBI NameMan-β1-6-Ins-1-P-Cer(d20:0/2-OH-26:0)
Stars
ASCII NameMan-beta1-6-Ins-1-P-Cer(d20:0/2-OH-26:0)
DefinitionA mannosylated ceramide phosphoinositol compound having a hexacosanoyl group attached to the ceramide nitrogen, with hydroxylation at C-2 of the very-long-chain fatty acid.
Last Modified18 January 2021
Submitterbheavner
DownloadsMolfile
FormulaC58H114NO17P
Net Charge0
Average Mass1128.514
Monoisotopic Mass1127.78244
SMILESCCCCCCCCCCCCCCCCCCCCCCCCC(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]1OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)[C@H](O)CCCCCCCCCCCCCCCCC
InChIInChI=1S/C58H114NO17P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-27-29-31-33-35-37-39-41-46(62)57(70)59-44(45(61)40-38-36-34-32-30-28-26-18-16-14-12-10-8-6-4-2)43-73-77(71,72)76-56-53(68)51(66)50(65)52(67)55(56)75-58-54(69)49(64)48(63)47(42-60)74-58/h44-56,58,60-69H,3-43H2,1-2H3,(H,59,70)(H,71,72)/t44-,45+,46?,47+,48+,49-,50+,51+,52-,53+,54-,55+,56+,58?/m0/s1
InChIKeyIOXZTTXRRSAOCW-WWEVDHMVSA-N
ChEBI Ontology
Outgoing Relation(s)
Man-β1-6-Ins-1-P-Cer(d20:0/2-OH-26:0) (CHEBI:60419) has functional parent Ins-1-P-Cer(d18:0/2-OH-26:0) (CHEBI:60409)
Man-β1-6-Ins-1-P-Cer(d20:0/2-OH-26:0) (CHEBI:60419) 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(d20:0/2-OH-26:0) (CHEBI:60442) has functional parent Man-β1-6-Ins-1-P-Cer(d20:0/2-OH-26:0) (CHEBI:60419)
IUPAC Names 
(2S,3R)-3-hydroxy-2-[(2-hydroxyhexacosanoyl)amino]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,3R)-3-hydroxy-2-[(2-hydroxyhexacosanoyl)amino]icosyl hydrogen phosphate}
Synonyms  Source
MIPC-B' (C26)SUBMITTER
MIPC-2' (C26)SUBMITTER
mannosylinositol phosphorylceramide B' (C26)ChEBI
mannosylinositol phosphorylceramide B' (20:0/26:0)ChEBI
Citations