CHEBI:70905 - N-icosanoyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-icosanoyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine
ChEBI ID CHEBI:70905
ChEBI ASCII Name N-icosanoyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine
Definition An N-acyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine in which the acyl group has 20 carbons and 0 double bonds.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Alan Bridge
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C42H87N2O7P
Net Charge 0
Average Mass 763.12310
Monoisotopic Mass 762.62509
InChI InChI=1S/C42H87N2O7P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-28-31-34-41(46)43-39(37-51-52(48,49)50-36-35-44(4,5)6)42(47)40(45)33-30-27-24-22-21-23-26-29-32-38(2)3/h38-40,42,45,47H,7-37H2,1-6H3,(H-,43,46,48,49)/t39-,40+,42-/m0/s1
InChIKey LLBOCCQTDNAVSD-LFVSMIGWSA-N
SMILES CCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](COP([O-])(=O)OCC[N+](C)(C)C)[C@H](O)[C@H](O)CCCCCCCCCCC(C)C
ChEBI Ontology
Outgoing N-icosanoyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70905) has functional parent 15-methylhexadecaphytosphingosine (CHEBI:70968)
N-icosanoyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70905) is a N-acyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70776)
Synonym Source
N-eicosanoyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine ChEBI
Last Modified
21 November 2012