CHEBI:72831 - 2-hexadecanoyl-1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1−)

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ChEBI Name 2-hexadecanoyl-1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1−)
ChEBI ID CHEBI:72831
ChEBI ASCII Name 2-hexadecanoyl-1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-)
Definition A 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1−) in which the 1- and 2-acyl groups are specified as octadecanoyl (stearoyl) and hexadecanoyl (palmitoyl) respectively; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C40H78O10P
Net Charge -1
Average Mass 750.01510
Monoisotopic Mass 749.53381
InChI InChI=1S/C40H79O10P/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-39(43)47-35-38(36-49-51(45,46)48-34-37(42)33-41)50-40(44)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h37-38,41-42H,3-36H2,1-2H3,(H,45,46)/p-1/t37-,38+/m0/s1
InChIKey WYVBOKLMHDFYQD-QPPIDDCLSA-M
SMILES CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)OC[C@@H](O)CO)OC(=O)CCCCCCCCCCCCCCC
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
(via phosphatidylglycerol(1-) )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-hexadecanoyl-1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1−) (CHEBI:72831) is a 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1−) (CHEBI:64716)
2-hexadecanoyl-1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1−) (CHEBI:72831) is conjugate base of 2-hexadecanoyl-1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol) (CHEBI:73207)
Incoming 2-hexadecanoyl-1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol) (CHEBI:73207) is conjugate acid of 2-hexadecanoyl-1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1−) (CHEBI:72831)
IUPAC Name
(2S)-2,3-dihydroxypropyl (2R)-2-(hexadecanoyloxy)-3-(octadecanoyloxy)propyl phosphate
Synonyms Sources
1-18:0-2-16:0-phosphatidylglycerol MetaCyc
1-octadecanoyl-2-hexadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol) UniProt
18:0-16:0-PG MetaCyc
2-palmitoyl-1-stearoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1−) ChEBI
PG(18:0/16:0) SUBMITTER
Manual Xref Database
CPD-8262 MetaCyc
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Last Modified
17 April 2013