CHEBI:77328 - 1-palmitoyl-2-(8-epi-prostaglandin F_2α)-sn-glycero-3-phosphocholine

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ChEBI Name 1-palmitoyl-2-(8-epi-prostaglandin F2α)-sn-glycero-3-phosphocholine ChEBI ID CHEBI:77328 ChEBI ASCII Name 1-palmitoyl-2-(8-epi-prostaglandin F2alpha)-sn-glycero-3-phosphocholine Definition A 1,2-diacyl-sn-glycero-3-phosphocholine in which the phosphatidyl acyl groups at positions 1 and 2 are specified as palmitoyl and 8-epi-prostaglandin F2α 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 C44H82NO11P Net Charge 0 Average Mass 832.09570 Monoisotopic Mass 831.56255 InChI InChI=1S/C44H82NO11P/c1-6-8-10-11-12-13-14-15-16-17-18-19-24-28-43(49)53-35-38(36-55-57(51,52)54-33-32-45(3,4)5)56-44(50)29-25-21-20-23-27-39-40(42(48)34-41(39)47)31-30-37(46)26-22-9-7-2/h20,23,30-31,37-42,46-48H,6-19,21-22,24-29,32-36H2,1-5H3/b23-20-,31-30+/t37-,38+,39-,40+,41-,42+/m0/s1 InChIKey NJHGFFOICHJLQM-JFFHRZTPSA-N SMILES CCCCCCCCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCC\C=C/C[C@@H]1[C@@H](O)C[C@@H](O)[C@@H]1\C=C\[C@@H](O)CCCCC ChEBI Ontology Outgoing 1-palmitoyl-2-(8-epi-prostaglandin F2α)-sn-glycero-3-phosphocholine (CHEBI:77328) has functional parent 8-epi-prostaglandin F2α (CHEBI:34505) 1-palmitoyl-2-(8-epi-prostaglandin F2α)-sn-glycero-3-phosphocholine (CHEBI:77328) has functional parent hexadecanoic acid (CHEBI:15756) 1-palmitoyl-2-(8-epi-prostaglandin F2α)-sn-glycero-3-phosphocholine (CHEBI:77328) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643) IUPAC Name (2R)-3-(hexadecanoyloxy)-2-{[(5Z,8β,9α,11α,13E,15S)-9,11,15-trihydroxy-1-oxoprosta-5,13-dien-1-yl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate Synonyms Sources 1-hexadecanoyl-2-(8-epi-prostaglandin F2αa)-sn-glycero-3-phosphocholine SUBMITTER 1-O-hexadecanoyl-2-(8-epi-prostaglandin F2α)-sn-glycero-3-phosphocholine UniProt Citation Type Source 16371369 PubMed citation SUBMITTER Last Modified 10 March 2014