CHEBI:71056 - 15-methylhexadecasphing-4-enine-1-phosphocholine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 15-methylhexadecasphing-4-enine-1-phosphocholine
ChEBI ID CHEBI:71056
Definition A phosphosphingolipid that is 15-methylhexadecasphing-4-enine substituted at position 1 by a phosphocholine moiety
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C22H47N2O5P
Net Charge 0
Average Mass 450.59270
Monoisotopic Mass 450.32226
InChI InChI=1S/C22H47N2O5P/c1-20(2)15-13-11-9-7-6-8-10-12-14-16-22(25)21(23)19-29-30(26,27)28-18-17-24(3,4)5/h14,16,20-22,25H,6-13,15,17-19,23H2,1-5H3/b16-14+/t21-,22+/m0/s1
InChIKey IKLLJLKSBDTNCU-DSKXTJLJSA-N
SMILES CC(C)CCCCCCCCC\C=C\[C@@H](O)[C@@H](N)COP([O-])(=O)OCC[N+](C)(C)C
ChEBI Ontology
Outgoing 15-methylhexadecasphing-4-enine-1-phosphocholine (CHEBI:71056) has functional parent 15-methylhexadecasphing-4-enine (CHEBI:70798)
15-methylhexadecasphing-4-enine-1-phosphocholine (CHEBI:71056) is a ammonium betaine (CHEBI:35284)
15-methylhexadecasphing-4-enine-1-phosphocholine (CHEBI:71056) is a phosphocholines (CHEBI:36700)
15-methylhexadecasphing-4-enine-1-phosphocholine (CHEBI:71056) is a phosphosphingolipid (CHEBI:35786)
15-methylhexadecasphing-4-enine-1-phosphocholine (CHEBI:71056) is conjugate base of 15-methylhexadecasphing-4-enine-1-phosphocholine(1+) (CHEBI:71021)
Incoming N-acyl-15-methylhexadecasphing-4-enine-1-phosphocholine (CHEBI:70775) has functional parent 15-methylhexadecasphing-4-enine-1-phosphocholine (CHEBI:71056)
15-methylhexadecasphing-4-enine-1-phosphocholine(1+) (CHEBI:71021) is conjugate acid of 15-methylhexadecasphing-4-enine-1-phosphocholine (CHEBI:71056)
IUPAC Name
(2S,3R,4E)-2-amino-3-hydroxy-15-methylhexadec-4-en-1-yl 2-(trimethylazaniumyl)ethyl phosphate
Synonym Source
15-methylhexadecasphingosine-1-phosphocholine ChEBI
Last Modified
25 November 2014