CHEBI:70913 - N-(2-hydroxyicosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-(2-hydroxyicosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine
ChEBI ID CHEBI:70913
ChEBI ASCII Name N-(2-hydroxyicosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine
Definition An N-acyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine in which the acyl group has 20 carbons and 0 double bonds and is 2-hydroxylated.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Alan Bridge
Supplier Information
Download Molfile XML SDF
Formula C42H87N2O8P
Net Charge 0
Average Mass 779.12250
Monoisotopic Mass 778.62000
InChI InChI=1S/C42H87N2O8P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-24-27-30-33-40(46)42(48)43-38(36-52-53(49,50)51-35-34-44(4,5)6)41(47)39(45)32-29-26-23-21-20-22-25-28-31-37(2)3/h37-41,45-47H,7-36H2,1-6H3,(H-,43,48,49,50)/t38-,39+,40?,41-/m0/s1
InChIKey KUQUUDTTZPICJN-KGXKBISVSA-N
SMILES CCCCCCCCCCCCCCCCCCC(O)C(=O)N[C@@H](COP([O-])(=O)OCC[N+](C)(C)C)[C@H](O)[C@H](O)CCCCCCCCCCC(C)C
ChEBI Ontology
Outgoing N-(2-hydroxyicosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70913) has functional parent 15-methylhexadecaphytosphingosine (CHEBI:70968)
N-(2-hydroxyicosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70913) is a N-acyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70776)
Synonyms Sources
4-hydroxy-N-(2-hydroxyeicosanoyl)-15-methylhexadecasphinganine-1-phosphocholine ChEBI
4-hydroxy-N-(2-hydroxyicosanoyl)-15-methylhexadecasphinganine-1-phosphocholine ChEBI
N-(2-hydroxyeicosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine ChEBI
Last Modified
21 November 2012