CHEBI:78368 - 1-hexadecyl-2-butanoyl-sn-glycero-3-phosphocholine

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ChEBI Name 1-hexadecyl-2-butanoyl-sn-glycero-3-phosphocholine ChEBI ID CHEBI:78368 ChEBI ASCII Name 1-hexadecyl-2-butanoyl-sn-glycero-3-phosphocholine Definition A 2-acyl-1-alkyl-sn-glycero-3-phosphocholine in which the alkyl and the acyl groups at positions 1 and 2 are hexadecyl and butanoyl respectively. 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 C28H58NO7P Net Charge 0 Average Mass 551.73640 Monoisotopic Mass 551.39509 InChI InChI=1S/C28H58NO7P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-23-33-25-27(36-28(30)21-7-2)26-35-37(31,32)34-24-22-29(3,4)5/h27H,6-26H2,1-5H3/t27-/m1/s1 InChIKey UVHUBDICYDPLIO-HHHXNRCGSA-N SMILES CCCCCCCCCCCCCCCCOC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCC ChEBI Ontology Outgoing 1-hexadecyl-2-butanoyl-sn-glycero-3-phosphocholine (CHEBI:78368) is a 2-acyl-1-alkyl-sn-glycero-3-phosphocholine (CHEBI:36702) 1-hexadecyl-2-butanoyl-sn-glycero-3-phosphocholine (CHEBI:78368) is a butyrate ester (CHEBI:50477) IUPAC Name (2R)-2-(butyryloxy)-3-(hexadecyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate Synonyms Sources 1-hexadecyl-2-butyryl-sn-glycero-3-phosphocholine ChEBI 1-O-hexadecyl-2-butanoyl-sn-glycero-3-phosphocholine UniProt PC(O-16:0/4:0) ChEBI Manual Xref Database LMGP01020072 LIPID MAPS View more database links Registry Number Type Source 15471643 Reaxys Registry Number Reaxys Citation Type Source 7673213 PubMed citation SUBMITTER Last Modified 26 August 2015