CHEBI:73091 - 1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)
ChEBI ID CHEBI:73091
ChEBI ASCII Name 1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)
Definition A 1-acyl-sn-glycero 3-phospho-(1'-sn-glycerol) in which the acyl group is specified as octadecanoyl (stearoyl).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C24H49O9P
Net Charge 0
Average Mass 512.61420
Monoisotopic Mass 512.31142
InChI InChI=1S/C24H49O9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(28)31-19-23(27)21-33-34(29,30)32-20-22(26)18-25/h22-23,25-27H,2-21H2,1H3,(H,29,30)/t22-,23+/m0/s1
InChIKey HFJVKBVEKQHVTO-XZOQPEGZSA-N
SMILES CCCCCCCCCCCCCCCCCC(=O)OC[C@@H](O)COP(O)(=O)OC[C@@H](O)CO
ChEBI Ontology
Outgoing 1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol) (CHEBI:73091) is a 1-acyl-sn-glycero-3-phospho-(1'-sn-glycerol) (CHEBI:64845)
1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol) (CHEBI:73091) is conjugate acid of 1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1−) (CHEBI:72827)
Incoming 1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1−) (CHEBI:72827) is conjugate base of 1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol) (CHEBI:73091)
IUPAC Name
(2R)-3-({[(2S)-2,3-dihydroxypropoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropyl octadecanoate
Synonyms Sources
(2R)-3-({[(2S)-2,3-dihydroxypropoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropyl stearate IUPAC
1-stearoyl-sn-glycero-3-phospho-(1'-sn-glycerol) ChEBI
PG(18:0/0:0) LIPID MAPS
Manual Xref Database
LMGP04050009 LIPID MAPS
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Registry Number Type Source
20444696 Reaxys Registry Number Reaxys
Last Modified
03 April 2013