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CHEBI:185270 - PA(A-25:0/A-17:0)

ChEBI IDCHEBI:185270
ChEBI NamePA(A-25:0/A-17:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC45H89O8P
Net Charge0
Average Mass789.173
Monoisotopic Mass788.62951
SMILESCCC(C)CCCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)O)OC(=O)CCCCCCCCCCCCC(C)CC
InChIInChI=1S/C45H89O8P/c1-5-41(3)35-31-27-23-19-15-13-11-9-7-8-10-12-14-16-21-25-29-33-37-44(46)51-39-43(40-52-54(48,49)50)53-45(47)38-34-30-26-22-18-17-20-24-28-32-36-42(4)6-2/h41-43H,5-40H2,1-4H3,(H2,48,49,50)/t41?,42?,43-/m1/s1
InChIKeyBVXUZMQYWLKRFF-RPOUZCTQSA-N
Species of MetaboliteComponentSourceComments
Bos taurus (ncbitaxon:9913) spermatozoon (BTO:0001277) MetaboLights (MTBLS1071) Strain: Holstein [LBO:0000132]
Roles Classification
Biological Role:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
PA(A-25:0/A-17:0) (CHEBI:185270) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name 
[(2R)-2-(14-methylhexadecanoyloxy)-3-phosphonooxypropyl] 22-methyltetracosanoate
Manual XrefsDatabases
74877498ChemSpider
HMDB0115760HMDB