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CHEBI:70885 - N-(2-hydroxyhexadecanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine

ChEBI IDCHEBI:70885
ChEBI NameN-(2-hydroxyhexadecanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine
Stars
ASCII NameN-(2-hydroxyhexadecanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine
DefinitionAn N-acyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine in which the acyl group has 16 carbons and 0 double bonds and is 2-hydroxylated.
Last Modified21 November 2012
SubmitterAlan Bridge
DownloadsMolfile
FormulaC38H79N2O8P
Net Charge0
Average Mass723.030
Monoisotopic Mass722.55740
SMILESCCCCCCCCCCCCCCC(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/C38H79N2O8P/c1-7-8-9-10-11-12-13-14-15-20-23-26-29-36(42)38(44)39-34(32-48-49(45,46)47-31-30-40(4,5)6)37(43)35(41)28-25-22-19-17-16-18-21-24-27-33(2)3/h33-37,41-43H,7-32H2,1-6H3,(H-,39,44,45,46)/t34-,35+,36?,37-/m0/s1
InChIKeyFGVRAQRYYWJMNQ-FXKDJHKMSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(2-hydroxyhexadecanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70885) has functional parent 15-methylhexadecaphytosphingosine (CHEBI:70968)
N-(2-hydroxyhexadecanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70885) is a N-acyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70776)
Synonym  Source
4-hydroxy-N-(2-hydroxyhexadecanoyl)-15-methylhexadecasphinganine-1-phosphocholineChEBI