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CHEBI:185125 - PS(DIME(13,5)/DIME(11,5))

ChEBI IDCHEBI:185125
ChEBI NamePS(DIME(13,5)/DIME(11,5))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC52H90NO12P
Net Charge0
Average Mass952.261
Monoisotopic Mass951.62006
SMILESCCCCCc1oc(CCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC(N)C(=O)O)OC(=O)CCCCCCCCCCc2oc(CCCCC)c(C)c2C)c(C)c1C
InChIInChI=1S/C52H90NO12P/c1-7-9-25-31-46-40(3)42(5)48(64-46)33-27-21-17-13-11-12-14-19-23-29-35-50(54)60-37-44(38-61-66(58,59)62-39-45(53)52(56)57)63-51(55)36-30-24-20-16-15-18-22-28-34-49-43(6)41(4)47(65-49)32-26-10-8-2/h44-45H,7-39,53H2,1-6H3,(H,56,57)(H,58,59)
InChIKeyVPFVHYPUQNLVRM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bos taurus (ncbitaxon:9913) spermatozoon (BTO:0001277) MetaboLights (MTBLS1071) Strain: Holstein [LBO:0000132]
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
PS(DIME(13,5)/DIME(11,5)) (CHEBI:185125) is a phosphatidyl-L-serine (CHEBI:18303)
IUPAC Name 
2-amino-3-[[3-[13-(3,4-dimethyl-5-pentyluran-2-yl)tridecanoyloxy]-2-[11-(3,4-dimethyl-5-pentyluran-2-yl)undecanoyloxy]propoxy]-hydroxyphosphoryl]oxypropanoic acid
Manual XrefsDatabases
74849543ChemSpider
HMDB0061571HMDB