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CHEBI:184342 - PS(DIME(9,5)/DIME(13,5))

ChEBI IDCHEBI:184342
ChEBI NamePS(DIME(9,5)/DIME(13,5))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC50H86NO12P
Net Charge0
Average Mass924.207
Monoisotopic Mass923.58876
SMILESCCCCCc1oc(CCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCc2oc(CCCCC)c(C)c2C)COP(=O)(O)OCC(N)C(=O)O)c(C)c1C
InChIInChI=1S/C50H86NO12P/c1-7-9-23-29-44-38(3)40(5)46(62-44)31-25-19-15-13-11-12-14-16-22-28-34-49(53)61-42(36-59-64(56,57)60-37-43(51)50(54)55)35-58-48(52)33-27-21-18-17-20-26-32-47-41(6)39(4)45(63-47)30-24-10-8-2/h42-43H,7-37,51H2,1-6H3,(H,54,55)(H,56,57)
InChIKeyROBSJMZZSXGTOF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bos taurus (ncbitaxon:9913)
spermatozoon (BTO:0001277) MetaboLights (MTBLS1071) Strain: Holstein-Friesian cattle [26105007]
spermatozoon (FMA:67338) MetaboLights (MTBLS1071) Strain: Holstein-Friesian cattle [26105007]
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(9,5)/DIME(13,5)) (CHEBI:184342) is a phosphatidyl-L-serine (CHEBI:18303)
IUPAC Name 
2-amino-3-[[3-[9-(3,4-dimethyl-5-pentyluran-2-yl)nonanoyloxy]-2-[13-(3,4-dimethyl-5-pentyluran-2-yl)tridecanoyloxy]propoxy]-hydroxyphosphoryl]oxypropanoic acid
Manual XrefsDatabases
74849562ChemSpider
HMDB0061590HMDB