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CHEBI:70904 - N-(2-hydroxyicosanoyl)-15-methylhexadecasphing-4-enine-1-phosphocholine

ChEBI IDCHEBI:70904
ChEBI NameN-(2-hydroxyicosanoyl)-15-methylhexadecasphing-4-enine-1-phosphocholine
Stars
ASCII NameN-(2-hydroxyicosanoyl)-15-methylhexadecasphing-4-enine-1-phosphocholine
DefinitionA N-acyl-15-methylhexadecasphing-4-enine-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
FormulaC42H85N2O7P
Net Charge0
Average Mass761.123
Monoisotopic Mass760.60944
SMILESCCCCCCCCCCCCCCCCCCC(O)C(=O)N[C@@H](COP(=O)([O-])OCC[N+](C)(C)C)[C@H](O)/C=C/CCCCCCCCCC(C)C
InChIInChI=1S/C42H85N2O7P/c1-7-8-9-10-11-12-13-14-15-16-17-18-21-25-28-31-34-41(46)42(47)43-39(37-51-52(48,49)50-36-35-44(4,5)6)40(45)33-30-27-24-22-19-20-23-26-29-32-38(2)3/h30,33,38-41,45-46H,7-29,31-32,34-37H2,1-6H3,(H-,43,47,48,49)/b33-30+/t39-,40+,41?/m0/s1
InChIKeyRVVUSUSGQSRNIR-XIXQLRCCSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(2-hydroxyicosanoyl)-15-methylhexadecasphing-4-enine-1-phosphocholine (CHEBI:70904) has functional parent 15-methylhexadecasphing-4-enine (CHEBI:70798)
N-(2-hydroxyicosanoyl)-15-methylhexadecasphing-4-enine-1-phosphocholine (CHEBI:70904) is a N-acyl-15-methylhexadecasphing-4-enine-1-phosphocholine (CHEBI:70775)
Synonym  Source
N-(2-hydroxyeicosanoyl)-15-methylhexadecasphing-4-enine-1-phosphocholineChEBI