CHEBI:72860 - 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphate(2−)

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ChEBI Name 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphate(2−)
ChEBI ID CHEBI:72860
ChEBI ASCII Name 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphate(2-)
Definition A 1,2-diacyl-sn-glycerol 3-phosphate(2−) in which the 1- and 2-acyl groups are specified as hexadecanoyl (palmitoyl) and 9Z,12Z-octadecadienoyl (linoleoyl) respectively; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter abridge
Supplier Information
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Formula C37H67O8P
Net Charge -2
Average Mass 670.89680
Monoisotopic Mass 670.45845
InChI InChI=1S/C37H69O8P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-37(39)45-35(34-44-46(40,41)42)33-43-36(38)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h11,13,17-18,35H,3-10,12,14-16,19-34H2,1-2H3,(H2,40,41,42)/p-2/b13-11-,18-17-/t35-/m1/s1
InChIKey YQMUIZXKIKXZHD-UMKNCJEQSA-L
SMILES CCCCCCCCCCCCCCCC(=O)OC[C@H](COP([O-])([O-])=O)OC(=O)CCCCCCC\C=C/C\C=C/CCCCC
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
(via phosphatidate(2-) )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphate(2−) (CHEBI:72860) is a 1,2-diacyl-sn-glycerol 3-phosphate(2−) (CHEBI:58608)
1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphate(2−) (CHEBI:72860) is conjugate base of 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphate (CHEBI:73259)
Incoming 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphate (CHEBI:73259) is conjugate acid of 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphate(2−) (CHEBI:72860)
IUPAC Name
(2R)-2-[(9Z,12Z)-octadeca-9,12-dienoyloxy]-3-(hexadecanoyloxy)propyl phosphate
Synonyms Sources
1-16:0-2-18:2-phosphatidate MetaCyc
1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphate UniProt
1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphate(2−) SUBMITTER
2-linoleoyl-1-palmitoyl-sn-glycero-3-phosphate(2−) ChEBI
PA(16:0/18:2(9Z,12Z)) SUBMITTER
Manual Xref Database
CPD-8265 MetaCyc
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Last Modified
22 April 2013