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CHEBI:70956 - N-(2-hydroxyheptacosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine

ChEBI IDCHEBI:70956
ChEBI NameN-(2-hydroxyheptacosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine
Stars
ASCII NameN-(2-hydroxyheptacosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine
DefinitionAn N-acyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine in which the acyl group has 27 carbons and 0 double bonds and is 2-hydroxylated.
Last Modified26 November 2012
SubmitterAlan Bridge
DownloadsMolfile
FormulaC49H101N2O8P
Net Charge0
Average Mass877.327
Monoisotopic Mass876.72955
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCC(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/C49H101N2O8P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-31-34-37-40-47(53)49(55)50-45(43-59-60(56,57)58-42-41-51(4,5)6)48(54)46(52)39-36-33-30-28-27-29-32-35-38-44(2)3/h44-48,52-54H,7-43H2,1-6H3,(H-,50,55,56,57)/t45-,46+,47?,48-/m0/s1
InChIKeyYZOUWIXDXMGCLC-YKHQHKJGSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(2-hydroxyheptacosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70956) has functional parent 15-methylhexadecaphytosphingosine (CHEBI:70968)
N-(2-hydroxyheptacosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70956) is a N-acyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70776)
Synonym  Source
4-hydroxy-N-(2-hydroxyheptacosanoyl)-15-methylhexadecasphinganine-1-phosphocholineChEBI