CHEBI:65157 - Man-1-6-Ins-1-P-Cer(d20:0/26:0)(1−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Man-1-6-Ins-1-P-Cer(d20:0/26:0)(1−)
ChEBI ID CHEBI:65157
ChEBI ASCII Name Man-1-6-Ins-1-P-Cer(d20:0/26:0)(1-)
Definition A mannosylinositol phosphorylceramide(1−) having a hexacosanoyl group amide-linked to a C20 sphinganine base, with no hydroxylation at C-4 of the long-chain base or on the C26 very-long-chain fatty acid.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter AnneNiknejad
Supplier Information
Download Molfile XML SDF
Formula C58H113NO16P
Net Charge -1
Average Mass 1111.48870
Monoisotopic Mass 1110.78025
InChI InChI=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)/p-1/t45-,46+,47+,49+,50-,51+,52+,53-,54+,55-,56+,57+,58?/m0/s1
InChIKey XGYQPQQQKFLIET-KSXPKWGSSA-M
SMILES CCCCCCCCCCCCCCCCCCCCCCCCCC(=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
ChEBI Ontology
Outgoing Man-1-6-Ins-1-P-Cer(d20:0/26:0)(1−) (CHEBI:65157) is a Man-1-6-Ins-1-P-Cer(d20:0)(1−) (CHEBI:138894)
Man-1-6-Ins-1-P-Cer(d20:0/26:0)(1−) (CHEBI:65157) is conjugate base of Man-1-6-Ins-1-P-Cer(d20:0/26:0) (CHEBI:65229)
Incoming Man-1-6-Ins-1-P-Cer(d20:0/26:0) (CHEBI:65229) is conjugate acid of Man-1-6-Ins-1-P-Cer(d20:0/26:0)(1−) (CHEBI:65157)
IUPAC Name
(2S,3S)-2-(hexacosanoylamino)-3-hydroxyicosyl (1R,2R,3R,4R,5S,6R)-2,3,4,5-tetrahydroxy-6-(D-mannopyranosyloxy)cyclohexyl phosphate
Last Modified
18 January 2021
General Comment
2021-01-18 The compound was previously incorrectly named as Man-1-2-Ins-1-P-Cer(d20:0/26:0)(1−).