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CHEBI:70940 - N-pentacosanoyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine

ChEBI IDCHEBI:70940
ChEBI NameN-pentacosanoyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine
Stars
ASCII NameN-pentacosanoyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine
DefinitionAn N-acyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine in which the acyl group has 25 carbons and 0 double bonds.
Last Modified22 November 2012
SubmitterAlan Bridge
DownloadsMolfile
FormulaC47H97N2O7P
Net Charge0
Average Mass833.274
Monoisotopic Mass832.70334
SMILESCCCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](COP(=O)([O-])OCC[N+](C)(C)C)[C@H](O)[C@H](O)CCCCCCCCCCC(C)C
InChIInChI=1S/C47H97N2O7P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-30-33-36-39-46(51)48-44(42-56-57(53,54)55-41-40-49(4,5)6)47(52)45(50)38-35-32-29-27-26-28-31-34-37-43(2)3/h43-45,47,50,52H,7-42H2,1-6H3,(H-,48,51,53,54)/t44-,45+,47-/m0/s1
InChIKeyPXALBCATZKLJLS-BOPYQAQKSA-N
ChEBI Ontology
Outgoing Relation(s)
N-pentacosanoyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70940) has functional parent 15-methylhexadecaphytosphingosine (CHEBI:70968)
N-pentacosanoyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70940) is a N-acyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70776)
Synonym  Source
4-hydroxy-15-methyl-N-pentacosanoylhexadecasphinganine-1-phosphocholineChEBI