CHEBI:192196 - PS(15:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

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ChEBI Name PS(15:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
ChEBI ID CHEBI:192196
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C43H72NO10P
Net Charge 0
Average Mass 794.020
Monoisotopic Mass 793.48938
InChI InChI=1S/C43H72NO10P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-42(46)54-39(37-52-55(49,50)53-38-40(44)43(47)48)36-51-41(45)34-32-30-28-26-24-16-14-12-10-8-6-4-2/h5,7,11,13,17-18,20-21,23,25,29,31,39-40H,3-4,6,8-10,12,14-16,19,22,24,26-28,30,32-38,44H2,1-2H3,(H,47,48)(H,49,50)/b7-5-,13-11-,18-17-,21-20-,25-23-,31-29-/t39-,40+/m1/s1
InChIKey MFRBFQDOGPHKJC-MCYISNOQSA-N
SMILES P(OC[C@H](OC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)COC(=O)CCCCCCCCCCCCCC)(OC[C@H](N)C(O)=O)(O)=O
Metabolite of Species Details
Marine plankton environmental sample (NCBI:txid632957) Found in endometabolome (MTBLS:000125). 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(15:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (CHEBI:192196) is a phosphatidyl-L-serine (CHEBI:18303)
IUPAC Name
(2S)-2-amino-3-[[(2R)-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]oxy-3-pentadecanoyloxypropoxy]-hydroxyphosphoryl]oxypropanoic acid
Manual Xrefs Databases
74875784 ChemSpider
HMDB0112339 HMDB
LMGP03010160 LIPID MAPS
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