CHEBI:70932 - N-(2-hydroxytetracosanoyl)-15-methylhexadecasphing-4-enine-1-phosphocholine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-(2-hydroxytetracosanoyl)-15-methylhexadecasphing-4-enine-1-phosphocholine
ChEBI ID CHEBI:70932
ChEBI ASCII Name N-(2-hydroxytetracosanoyl)-15-methylhexadecasphing-4-enine-1-phosphocholine
Definition An N-acyl-15-methylhexadecasphing-4-enine-1-phosphocholine in which the acyl group has 24 carbons and 0 double bonds and is 2-hydroxylated.
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 C46H93N2O7P
Net Charge 0
Average Mass 817.21360
Monoisotopic Mass 816.67204
InChI InChI=1S/C46H93N2O7P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-29-32-35-38-45(50)46(51)47-43(41-55-56(52,53)54-40-39-48(4,5)6)44(49)37-34-31-28-26-23-24-27-30-33-36-42(2)3/h34,37,42-45,49-50H,7-33,35-36,38-41H2,1-6H3,(H-,47,51,52,53)/b37-34+/t43-,44+,45?/m0/s1
InChIKey GEZVGPOLMSEFNA-BSDIBIDVSA-N
SMILES CCCCCCCCCCCCCCCCCCCCCCC(O)C(=O)N[C@@H](COP([O-])(=O)OCC[N+](C)(C)C)[C@H](O)\C=C\CCCCCCCCCC(C)C
ChEBI Ontology
Outgoing N-(2-hydroxytetracosanoyl)-15-methylhexadecasphing-4-enine-1-phosphocholine (CHEBI:70932) has functional parent 15-methylhexadecasphing-4-enine (CHEBI:70798)
N-(2-hydroxytetracosanoyl)-15-methylhexadecasphing-4-enine-1-phosphocholine (CHEBI:70932) is a N-acyl-15-methylhexadecasphing-4-enine-1-phosphocholine (CHEBI:70775)
Last Modified
22 November 2012