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

ChEBI IDCHEBI:70913
ChEBI NameN-(2-hydroxyicosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine
Stars
ASCII NameN-(2-hydroxyicosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine
DefinitionAn N-acyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine in which the acyl group has 20 carbons and 0 double bonds and is 2-hydroxylated.
Last Modified21 November 2012
SubmitterAlan Bridge
DownloadsMolfile
FormulaC42H87N2O8P
Net Charge0
Average Mass779.138
Monoisotopic Mass778.62000
SMILESCCCCCCCCCCCCCCCCCCC(O)C(=O)N[C@@H](COP(=O)([O-])OCC[N+](C)(C)C)[C@H](O)[C@H](O)CCCCCCCCCCC(C)C
InChIInChI=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
InChIKeyKUQUUDTTZPICJN-KGXKBISVSA-N
ChEBI Ontology
Outgoing Relation(s)
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  Source
4-hydroxy-N-(2-hydroxyeicosanoyl)-15-methylhexadecasphinganine-1-phosphocholineChEBI
4-hydroxy-N-(2-hydroxyicosanoyl)-15-methylhexadecasphinganine-1-phosphocholineChEBI
N-(2-hydroxyeicosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholineChEBI