CHEBI:85350 - CDP-1-palmitoyl-2-arachidonoyl-sn-glycerol(2−)

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ChEBI Name CDP-1-palmitoyl-2-arachidonoyl-sn-glycerol(2−)
ChEBI ID CHEBI:85350
ChEBI ASCII Name CDP-1-palmitoyl-2-arachidonoyl-sn-glycerol(2-)
Definition A CDP-diacylglycerol(2−) obtained by deprotonation of the diphosphate OH groups of CDP-1-palmitoyl-2-arachidonoyl-sn-glycerol; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Nevila Nouspikel
Supplier Information
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Formula C48H79N3O15P2
Net Charge -2
Average Mass 1000.10060
Monoisotopic Mass 999.49974
InChI InChI=1S/C48H81N3O15P2/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-44(53)64-40(37-61-43(52)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2)38-62-67(57,58)66-68(59,60)63-39-41-45(54)46(55)47(65-41)51-36-35-42(49)50-48(51)56/h11,13,17-18,20,22,26,28,35-36,40-41,45-47,54-55H,3-10,12,14-16,19,21,23-25,27,29-34,37-39H2,1-2H3,(H,57,58)(H,59,60)(H2,49,50,56)/p-2/b13-11-,18-17-,22-20-,28-26-/t40-,41-,45-,46-,47-/m1/s1
InChIKey GMBXECXXNMMIAN-BVUIXUOUSA-L
SMILES CCCCCCCCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ccc(N)nc1=O)OC(=O)CCC\C=C/C\C=C/C\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 CDP-diacylglycerol(2-) )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing CDP-1-palmitoyl-2-arachidonoyl-sn-glycerol(2−) (CHEBI:85350) has role human metabolite (CHEBI:77746)
CDP-1-palmitoyl-2-arachidonoyl-sn-glycerol(2−) (CHEBI:85350) is a CDP-diacylglycerol(2−) (CHEBI:58332)
IUPAC Name
5'-O-[({[(2R)-3-(hexadecanoyloxy)-2-{[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxy}propoxy]phosphinato}oxy)phosphinato]cytidine
Synonyms Sources
1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-cytidine-5ʼ-diphosphate UniProt
1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycero-3-cytidine-5ʼ-diphosphate(2−) ChEBI
CDP-1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycerol(2−) ChEBI
CDP-1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycerol(2−) ChEBI
CDP-DG(18:0/20:4(5Z,8Z,11Z,14Z)) ChEBI
Citation Waiting for Citations Type Source
25375833 PubMed citation SUBMITTER
Last Modified
09 March 2017