CHEBI:104121 - 1,2-dioctadecanoyl-sn-glycero-3-cytidine 5'-diphosphate

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ChEBI Name 1,2-dioctadecanoyl-sn-glycero-3-cytidine 5'-diphosphate
ChEBI ID CHEBI:104121
ChEBI ASCII Name 1,2-dioctadecanoyl-sn-glycero-3-cytidine 5'-diphosphate
Definition A CDP-diacylglycerol in which both of the phosphatidyl acyl groups are specified as octadecanoyl (stearoyl).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C48H89N3O15P2
Net Charge 0
Average Mass 1010.181
Monoisotopic Mass 1009.577
InChI InChI=1S/C48H89N3O15P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-43(52)61-37-40(64-44(53)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)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/h35-36,40-41,45-47,54-55H,3-34,37-39H2,1-2H3,(H,57,58)(H,59,60)(H2,49,50,56)/t40-,41-,45-,46-,47-/m1/s1
InChIKey PDCWLWQTNQCGRI-IGIWICMZSA-N
SMILES O(C[C@@H](COC(CCCCCCCCCCCCCCCCC)=O)OC(CCCCCCCCCCCCCCCCC)=O)P(OP(OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C(N=C(C=C2)N)=O)(=O)O)(=O)O
Metabolite of Species Details
Mycoplasma genitalium (NCBI:txid2097) See: PubMed
Roles Classification
Biological Role(s): Mycoplasma genitalium metabolite
Any bacterial metabolite produced during a metabolic reaction in Mycoplasma genitalium.
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 1,2-dioctadecanoyl-sn-glycero-3-cytidine 5'-diphosphate (CHEBI:104121) has functional parent octadecanoic acid (CHEBI:28842)
1,2-dioctadecanoyl-sn-glycero-3-cytidine 5'-diphosphate (CHEBI:104121) has role Mycoplasma genitalium metabolite (CHEBI:131604)
1,2-dioctadecanoyl-sn-glycero-3-cytidine 5'-diphosphate (CHEBI:104121) is a CDP-diacylglycerol (CHEBI:17962)
IUPAC Name
5'-O-[({[(2R)-2,3-bis(octadecanoyloxy)propoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]cytidine
Synonyms Sources
1,2-distearoyl-sn-glycero-3-cytidine 5'-diphosphate ChEBI
CDP-1,2-dioctadecanoyl-sn-glycerol ChEBI
CDP-1,2-dioctadecanoylglycerol ChEBI
CDP-1,2-distearoyl-sn-glycerol ChEBI
CDP-1,2-distearoylglycerol ChEBI
CDP-DG(18:0/18:0) ChEBI
CDP-DG(36:0) HMDB
CDP-Diacylglycerol(18:0/18:0) HMDB
CDP-Diacylglycerol(36:0) HMDB
Manual Xrefs Databases
CPD-12814 MetaCyc
HMDB0006978 HMDB
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Citation Waiting for Citations Type Source
22817898 PubMed citation Europe PMC
Last Modified
05 April 2016