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CHEBI:70884 - N-heptadecanoyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine

ChEBI IDCHEBI:70884
ChEBI NameN-heptadecanoyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine
Stars
ASCII NameN-heptadecanoyl-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.
Last Modified21 November 2012
SubmitterAlan Bridge
DownloadsMolfile
FormulaC39H81N2O7P
Net Charge0
Average Mass721.058
Monoisotopic Mass720.57814
SMILESCCCCCCCCCCCCCCCCC(=O)N[C@@H](COP(=O)([O-])OCC[N+](C)(C)C)[C@H](O)[C@H](O)CCCCCCCCCCC(C)C
InChIInChI=1S/C39H81N2O7P/c1-7-8-9-10-11-12-13-14-15-16-17-22-25-28-31-38(43)40-36(34-48-49(45,46)47-33-32-41(4,5)6)39(44)37(42)30-27-24-21-19-18-20-23-26-29-35(2)3/h35-37,39,42,44H,7-34H2,1-6H3,(H-,40,43,45,46)/t36-,37+,39-/m0/s1
InChIKeyJJPHEMBYRSTKCE-UIJXAYEMSA-N
ChEBI Ontology
Outgoing Relation(s)
N-heptadecanoyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70884) has functional parent 15-methylhexadecaphytosphingosine (CHEBI:70968)
N-heptadecanoyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70884) is a N-acyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70776)