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CHEBI:70911 - N-2-hydroxy-henicosanoyl-15-methylhexadecasphing-4-enine-1-phosphocholine

ChEBI IDCHEBI:70911
ChEBI NameN-2-hydroxy-henicosanoyl-15-methylhexadecasphing-4-enine-1-phosphocholine
Stars
ASCII NameN-2-hydroxy-henicosanoyl-15-methylhexadecasphing-4-enine-1-phosphocholine
DefinitionAn N-acyl-15-methylhexadecasphing-4-enine-1-phosphocholine in which the acyl group has 21 carbons and 0 double bonds and is 2-hydroxylated.
Last Modified21 November 2012
SubmitterAlan Bridge
DownloadsMolfile
FormulaC43H87N2O7P
Net Charge0
Average Mass775.150
Monoisotopic Mass774.62509
SMILESCCCCCCCCCCCCCCCCCCCC(O)C(=O)N[C@@H](COP(=O)([O-])OCC[N+](C)(C)C)[C@H](O)/C=C/CCCCCCCCCC(C)C
InChIInChI=1S/C43H87N2O7P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-22-26-29-32-35-42(47)43(48)44-40(38-52-53(49,50)51-37-36-45(4,5)6)41(46)34-31-28-25-23-20-21-24-27-30-33-39(2)3/h31,34,39-42,46-47H,7-30,32-33,35-38H2,1-6H3,(H-,44,48,49,50)/b34-31+/t40-,41+,42?/m0/s1
InChIKeyAPDOHCXNXAIUDD-SNEAHRROSA-N
ChEBI Ontology
Outgoing Relation(s)
N-2-hydroxy-henicosanoyl-15-methylhexadecasphing-4-enine-1-phosphocholine (CHEBI:70911) has functional parent 15-methylhexadecasphing-4-enine (CHEBI:70798)
N-2-hydroxy-henicosanoyl-15-methylhexadecasphing-4-enine-1-phosphocholine (CHEBI:70911) is a N-acyl-15-methylhexadecasphing-4-enine-1-phosphocholine (CHEBI:70775)
Synonym  Source
N-2-hydroxy-heneicosanoyl-15-methylhexadecasphing-4-enine-1-phosphocholineChEBI