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CHEBI:185989 - PS(13:0/0:0)

ChEBI IDCHEBI:185989
ChEBI NamePS(13:0/0:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H38NO9P
Net Charge0
Average Mass455.485
Monoisotopic Mass455.22842
SMILESCCCCCCCCCCCCC(=O)OC[C@@H](O)COP(=O)(O)OC[C@H](N)C(=O)O
InChIInChI=1S/C19H38NO9P/c1-2-3-4-5-6-7-8-9-10-11-12-18(22)27-13-16(21)14-28-30(25,26)29-15-17(20)19(23)24/h16-17,21H,2-15,20H2,1H3,(H,23,24)(H,25,26)/t16-,17+/m1/s1
InChIKeyJHFVXCSIKSVHNN-SJORKVTESA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
PS(13:0/0:0) (CHEBI:185989) is a 1-acyl-sn-glycero-3-phosphoserine (CHEBI:52603)
IUPAC Name 
(2S)-2-amino-3-[hydroxy-[(2R)-2-hydroxy-3-tridecanoyloxypropoxy]phosphoryl]oxypropanoic acid
Manual XrefsDatabases
LMGP03050005LIPID MAPS
24823094ChemSpider