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CHEBI:70892 - N-(2-hydroxyheptadecanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine

ChEBI IDCHEBI:70892
ChEBI NameN-(2-hydroxyheptadecanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine
Stars
ASCII NameN-(2-hydroxyheptadecanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine
DefinitionAn N-acyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine in which the acyl group has 17 carbons and 0 double bonds and is 2-hydroxylated.
Last Modified21 November 2012
SubmitterAlan Bridge
DownloadsMolfile
FormulaC39H81N2O8P
Net Charge0
Average Mass737.057
Monoisotopic Mass736.57305
SMILESCCCCCCCCCCCCCCCC(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/C39H81N2O8P/c1-7-8-9-10-11-12-13-14-15-16-21-24-27-30-37(43)39(45)40-35(33-49-50(46,47)48-32-31-41(4,5)6)38(44)36(42)29-26-23-20-18-17-19-22-25-28-34(2)3/h34-38,42-44H,7-33H2,1-6H3,(H-,40,45,46,47)/t35-,36+,37?,38-/m0/s1
InChIKeyNAWONNSXNHCBKL-IEICXCTKSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(2-hydroxyheptadecanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70892) is a N-acyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70776)
Synonym  Source
4-hydroxy-N-(2-hydroxyheptadecanoyl)-15-methylhexadecasphinganine-1-phosphocholineChEBI