EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:186567 - MIPC(d18:0/18:0(2OH))

ChEBI IDCHEBI:186567
ChEBI NameMIPC(d18:0/18:0(2OH))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC48H94NO17P
Net Charge0
Average Mass988.244
Monoisotopic Mass987.62594
SMILESCCCCCCCCCCCCCCCCC(O)C(=O)N[C@@H](COP(=O)(O)O[C@H]1C(O)C(O)C(O)[C@@H](O)C1O[C@H]1O[C@H](CO)[C@@H](O)C(O)C1O)[C@H](O)CCCCCCCCCCCCCCC
InChIInChI=1S/C48H94NO17P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-36(52)47(60)49-34(35(51)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)33-63-67(61,62)66-46-43(58)41(56)40(55)42(57)45(46)65-48-44(59)39(54)38(53)37(32-50)64-48/h34-46,48,50-59H,3-33H2,1-2H3,(H,49,60)(H,61,62)/t34-,35+,36?,37+,38+,39?,40?,41?,42+,43?,44?,45?,46-,48+/m0/s1
InChIKeyQQJFOKDEKDXFJO-HOICHGOFSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
MIPC(d18:0/18:0(2OH)) (CHEBI:186567) is a phosphosphingolipid (CHEBI:35786)
IUPAC Name 
[(2S,3R)-3-hydroxy-2-(2-hydroxyoctadecanoylamino)octadecyl] [(1S,5R)-2,3,4,5-tetrahydroxy-6-[(2R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexyl] hydrogen phosphate
Manual XrefsDatabases
LMSP03030055LIPID MAPS