CHEBI:78254 - N-hexanoylsphingosine-1-phosphocholine

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ChEBI Name N-hexanoylsphingosine-1-phosphocholine ChEBI ID CHEBI:78254 ChEBI ASCII Name N-hexanoylsphingosine-1-phosphocholine Definition A sphingomyelin in which the ceramide N-acyl group is specified as hexanoyl. Stars This entity has been manually annotated by the ChEBI Team. Submitter Nevila Nouspikel Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C29H59N2O6P Net Charge 0 Average Mass 562.76230 Monoisotopic Mass 562.41107 InChI InChI=1S/C29H59N2O6P/c1-6-8-10-11-12-13-14-15-16-17-18-19-21-22-28(32)27(30-29(33)23-20-9-7-2)26-37-38(34,35)36-25-24-31(3,4)5/h21-22,27-28,32H,6-20,23-26H2,1-5H3,(H-,30,33,34,35)/b22-21+/t27-,28+/m0/s1 InChIKey AHZZHULAOVWYNO-RRKDMDGFSA-N SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](COP([O-])(=O)OCC[N+](C)(C)C)NC(=O)CCCCC ChEBI Ontology Outgoing N-hexanoylsphingosine-1-phosphocholine (CHEBI:78254) has functional parent hexanoic acid (CHEBI:30776) N-hexanoylsphingosine-1-phosphocholine (CHEBI:78254) is a sphingomyelin (CHEBI:64583) Incoming N-hexanoyl-sphingosine-1,3-cyclophosphate(1−) (CHEBI:143883) has functional parent N-hexanoylsphingosine-1-phosphocholine (CHEBI:78254) Synonyms Sources C6-sphingomyelin ChEBI N-hexanoyl-sphing-4-enine-1-phosphocholine UniProt N-hexanoylsphing-4-enine-1-phosphocholine ChEBI N-hexanoylsphingomyelin ChEBI SM(d18:1/6:0) ChEBI Registry Number Type Source 18539759 Reaxys Registry Number Reaxys Citation Type Source 19454763 PubMed citation SUBMITTER Last Modified 11 July 2014