CHEBI:189967 - PS(DiMe(9,3)/MonoMe(11,3))

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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 PS(DiMe(9,3)/MonoMe(11,3))
ChEBI ID CHEBI:189967
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C43H72NO12P
Net Charge 0
Average Mass 826.018
Monoisotopic Mass 825.47921
InChI InChI=1S/C43H72NO12P/c1-6-22-35-28-32(3)38(54-35)24-18-14-10-8-9-11-17-21-27-42(46)55-36(30-52-57(49,50)53-31-37(44)43(47)48)29-51-41(45)26-20-16-13-12-15-19-25-40-34(5)33(4)39(56-40)23-7-2/h28,36-37H,6-27,29-31,44H2,1-5H3,(H,47,48)(H,49,50)
InChIKey VAQMLCBSNHZPCQ-UHFFFAOYSA-N
SMILES P(OCC(OC(=O)CCCCCCCCCCC=1OC(=CC1C)CCC)COC(=O)CCCCCCCCC=2OC(=C(C2C)C)CCC)(OCC(N)C(O)=O)(O)=O
Metabolite of Species Details
marine plankton environmental sample (NCBI:txid632957) Found in endometabolome See: MetaboLights Study
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
(via phosphatidyl-L-serine )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing PS(DiMe(9,3)/MonoMe(11,3)) (CHEBI:189967) is a phosphatidyl-L-serine (CHEBI:18303)
IUPAC Name
2-amino-3-[[3-[9-(3,4-dimethyl-5-propyluran-2-yl)nonanoyloxy]-2-[11-(3-methyl-5-propyluran-2-yl)undecanoyloxy]propoxy]-hydroxyphosphoryl]oxypropanoic acid
Manual Xrefs Databases
74849556 ChemSpider
HMDB0061584 HMDB
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