CHEBI:184654 - Pe-nme(24:1(15Z)/20:2(11Z,14Z))

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Pe-nme(24:1(15Z)/20:2(11Z,14Z))
ChEBI ID CHEBI:184654
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C50H94NO8P
Net Charge 0
Average Mass 868.275
Monoisotopic Mass 867.67171
InChI InChI=1S/C50H94NO8P/c1-4-6-8-10-12-14-16-18-20-22-23-24-25-27-28-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51-3)59-50(53)43-41-39-37-35-33-31-29-26-21-19-17-15-13-11-9-7-5-2/h13,15,18-21,48,51H,4-12,14,16-17,22-47H2,1-3H3,(H,54,55)/b15-13-,20-18-,21-19-
InChIKey INBBJEQVPARZML-MXLPAPOISA-N
SMILES P(OCC(OC(=O)CCCCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCCCCC/C=C\CCCCCCCC)(OCCNC)(O)=O
Metabolite of Species Details
Bos taurus (NCBI:txid9913) Found in spermatozoon (BTO:0001277). of strain Holstein [LBO:0000132] See: MetaboLights Study
ChEBI Ontology
Outgoing Pe-nme(24:1(15Z)/20:2(11Z,14Z)) (CHEBI:184654) is a phosphatidylethanolamine (CHEBI:16038)
IUPAC Name
[3-[hydroxy-[2-(methylamino)ethoxy]phosphoryl]oxy-2-[(11Z,14Z)-icosa-11,14-dienoyl]oxypropyl] (Z)-tetracos-15-enoate
Manual Xrefs Databases
74850613 ChemSpider
HMDB0113742 HMDB
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