CHEBI:85829 - CDP-1-stearoyl-2-arachidonoyl-sn-glycerol

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ChEBI Name CDP-1-stearoyl-2-arachidonoyl-sn-glycerol ChEBI ID CHEBI:85829 ChEBI ASCII Name CDP-1-stearoyl-2-arachidonoyl-sn-glycerol Definition A CDP-diacylglycerol in which the phosphatidyl acyl groups at positions 1 and 2 are specified as stearoyl and arachidonoyl respectively. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C50H85N3O15P2 Net Charge 0 Average Mass 1030.16850 Monoisotopic Mass 1029.54559 InChI InChI=1S/C50H85N3O15P2/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-46(55)66-42(39-63-45(54)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2)40-64-69(59,60)68-70(61,62)65-41-43-47(56)48(57)49(67-43)53-38-37-44(51)52-50(53)58/h11,13,17,19,22,24,28,30,37-38,42-43,47-49,56-57H,3-10,12,14-16,18,20-21,23,25-27,29,31-36,39-41H2,1-2H3,(H,59,60)(H,61,62)(H2,51,52,58)/b13-11-,19-17-,24-22-,30-28-/t42-,43-,47-,48-,49-/m1/s1 InChIKey MXWMCLVKMTUATQ-UMHKXKCNSA-N SMILES CCCCCCCCCCCCCCCCCC(=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). Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. (via CDP-diacylglycerol ) mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). (via CDP-diacylglycerol ) View more via ChEBI Ontology ChEBI Ontology Outgoing CDP-1-stearoyl-2-arachidonoyl-sn-glycerol (CHEBI:85829) has functional parent arachidonic acid (CHEBI:15843) CDP-1-stearoyl-2-arachidonoyl-sn-glycerol (CHEBI:85829) has functional parent octadecanoic acid (CHEBI:28842) CDP-1-stearoyl-2-arachidonoyl-sn-glycerol (CHEBI:85829) has role human metabolite (CHEBI:77746) CDP-1-stearoyl-2-arachidonoyl-sn-glycerol (CHEBI:85829) is a CDP-diacylglycerol (CHEBI:17962) CDP-1-stearoyl-2-arachidonoyl-sn-glycerol (CHEBI:85829) is conjugate acid of CDP-1-stearoyl-2-arachidonoyl-sn-glycerol(2−) (CHEBI:85349) CDP-1-stearoyl-2-arachidonoyl-sn-glycerol (CHEBI:85829) is conjugate base of CDP-1-palmitoyl-2-arachidonoyl-sn-glycerol (CHEBI:85830) Incoming CDP-1-palmitoyl-2-arachidonoyl-sn-glycerol (CHEBI:85830) is conjugate acid of CDP-1-stearoyl-2-arachidonoyl-sn-glycerol (CHEBI:85829) CDP-1-stearoyl-2-arachidonoyl-sn-glycerol(2−) (CHEBI:85349) is conjugate base of CDP-1-stearoyl-2-arachidonoyl-sn-glycerol (CHEBI:85829) IUPAC Name 5'-O-[hydroxy({hydroxy[(2R)-2-{[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxy}-3-(octadecanoyloxy)propoxy]phosphoryl}oxy)phosphoryl]cytidine Synonyms Sources 1-Octadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-CDP HMDB 1-octadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-cytidine-5ʼ-diphosphate ChEBI 1-octadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycero-3-cytidine-5ʼ-diphosphate ChEBI 1-Stearoyl-2-arachidonoyl-sn-glycero-3-cytidine-5'-diphosphate HMDB CDP-1-octadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycerol ChEBI CDP-1-octadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycerol ChEBI CDP-DG(18:0/20:4) HMDB CDP-DG(18:0/20:4n6) HMDB CDP-DG(18:0/20:4w6) HMDB CDP-DG(38:4) HMDB CDP-Diacylglycerol(18:0/20:4) HMDB CDP-Diacylglycerol(18:0/20:4n6) HMDB CDP-Diacylglycerol(18:0/20:4w6) HMDB CDP-Diacylglycerol(38:4) HMDB Manual Xref Database HMDB0006982 HMDB View more database links Last Modified 21 May 2015