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CHEBI:72546 - Ins-1-P-Cer(d18:0/14:0)(1−)

ChEBI IDCHEBI:72546
ChEBI NameIns-1-P-Cer(d18:0/14:0)(1−)
Stars
ASCII NameIns-1-P-Cer(d18:0/14:0)(1-)
DefinitionAn inositol phosphodihydroceramide(1−) in which the N-acyl group is specified as myristoyl; major species at pH 7.3.
Last Modified11 April 2014
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC38H75NO11P
Net Charge-1
Average Mass752.988
Monoisotopic Mass752.50832
SMILESCCCCCCCCCCCCCCC[C@@H](O)[C@H](COP(=O)([O-])O[C@@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCCC
InChIInChI=1S/C38H76NO11P/c1-3-5-7-9-11-13-15-16-18-19-21-23-25-27-31(40)30(39-32(41)28-26-24-22-20-17-14-12-10-8-6-4-2)29-49-51(47,48)50-38-36(45)34(43)33(42)35(44)37(38)46/h30-31,33-38,40,42-46H,3-29H2,1-2H3,(H,39,41)(H,47,48)/p-1/t30-,31+,33-,34-,35+,36+,37+,38-/m0/s1
InChIKeyROACDTKYUXMDDP-NEEAIHQASA-M
ChEBI Ontology
Outgoing Relation(s)
Ins-1-P-Cer(d18:0/14:0)(1−) (CHEBI:72546) has functional parent N-tetradecanoylsphinganine (CHEBI:67045)
Ins-1-P-Cer(d18:0/14:0)(1−) (CHEBI:72546) is a inositol phosphodihydroceramide(1−) (CHEBI:64941)
IUPAC Name 
(2S,3R)-3-hydroxy-2-(tetradecanoylamino)octadecyl (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl phosphate
Synonyms  Source
IPC-A 18:0/14:0SUBMITTER
inositol-P-ceramide-A (18:0/14:0)SUBMITTER
inositol-P-ceramide-A (C14)SUBMITTER
IPC-1 (C14)SUBMITTER
IPC-A (C14)SUBMITTER