CHEBI:77329 - 1-stearoyl-2-(8-epi-prostaglandin F_2α)-sn-glycero-3-phosphocholine

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ChEBI Name 1-stearoyl-2-(8-epi-prostaglandin F2α)-sn-glycero-3-phosphocholine ChEBI ID CHEBI:77329 ChEBI ASCII Name 1-stearoyl-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 stearoyl 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 C46H86NO11P Net Charge 0 Average Mass 860.14890 Monoisotopic Mass 859.59385 InChI InChI=1S/C46H86NO11P/c1-6-8-10-11-12-13-14-15-16-17-18-19-20-21-26-30-45(51)55-37-40(38-57-59(53,54)56-35-34-47(3,4)5)58-46(52)31-27-23-22-25-29-41-42(44(50)36-43(41)49)33-32-39(48)28-24-9-7-2/h22,25,32-33,39-44,48-50H,6-21,23-24,26-31,34-38H2,1-5H3/b25-22-,33-32+/t39-,40+,41-,42+,43-,44+/m0/s1 InChIKey VUXINVFZDRMFRL-JRXYJGRISA-N SMILES CCCCCCCCCCCCCCCCCC(=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-stearoyl-2-(8-epi-prostaglandin F2α)-sn-glycero-3-phosphocholine (CHEBI:77329) has functional parent 8-epi-prostaglandin F2α (CHEBI:34505) 1-stearoyl-2-(8-epi-prostaglandin F2α)-sn-glycero-3-phosphocholine (CHEBI:77329) has functional parent octadecanoic acid (CHEBI:28842) 1-stearoyl-2-(8-epi-prostaglandin F2α)-sn-glycero-3-phosphocholine (CHEBI:77329) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643) IUPAC Name (2R)-3-(octadecanoyloxy)-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-O-octadecanoyl-2-(8-epi-prostaglandin F2α)-sn-glycero-3-phosphocholine UniProt 1-octadecanoyl-2-(8-epi-prostaglandin F2α)-sn-glycero-3-phosphocholine ChEBI Citation Type Source 16371369 PubMed citation SUBMITTER Last Modified 10 March 2014