OntologieschebiclassesCHEBI:60412   
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Ins-1-P-Cer(t18:0/26:0)
http://purl.obolibrary.org/obo/CHEBI_60412

A ceramide phosphoinositol compound having a hexacosanoyl group attached to the ceramide nitrogen, hydroxylation at C-4 of the long-chain base, and no additional hydroxylation of the very-long-chain fatty acid.

Also appears inslm
Exact Synonyms
(2S,3S,4S)-2-(hexacosanoylamino)-3,4-dihydroxyoctadecyl (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl hydrogen phosphate
(2S,3S,4S)-2-(hexacosanoylamino)-3,4-dihydroxyoctadecyl 1D-myo-inositol hydrogen phosphate
Related Synonyms
inositol-P-ceramide B (18:0/26:0)
inositol-P-ceramide B (C26)
IPC-2 (C26)
IPC-B (C26)
class Information
charge

0

formula

C50H100NO12P

has_obo_namespace

chebi_ontology

inchikey

ZAWCXEGDYSBAHF-OKCLXCGZSA-N

inchi

InChI=1S/C50H100NO12P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-29-31-33-35-37-39-43(53)51-41(40-62-64(60,61)63-50-48(58)46(56)45(55)47(57)49(50)59)44(54)42(52)38-36-34-32-30-28-16-14-12-10-8-6-4-2/h41-42,44-50,52,54-59H,3-40H2,1-2H3,(H,51,53)(H,60,61)/t41-,42-,44-,45-,46-,47+,48+,49+,50-/m0/s1

in_subset

3_STAR

mass

938.30230

monoisotopicmass

937.69831

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]1O)[C@H](O)[C@@H](O)CCCCCCCCCCCCCC

class Relations