Showing metabocard for CDP-DG(16:0/i-19:0) (MMDBc0056438)
Record Information | ||||||||||||||
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Version | 1.0 | |||||||||||||
Status | Detected and Quantified | |||||||||||||
Creation Date | 2022-07-07 21:48:37 UTC | |||||||||||||
Update Date | 2022-08-14 02:44:51 UTC | |||||||||||||
MiMeDB ID | MMDBc0056438 | |||||||||||||
Metabolite Identification | ||||||||||||||
Common Name | CDP-DG(16:0/i-19:0) | |||||||||||||
Description | CDP-DG(16:0/i-19:0) is a cytidine diphosphate diacylglycerol or CDP-diacylglycerol. It is a glycerophospholipid in which a cytidine diphosphate moiety occupies a glycerol substitution site. As is the case with diacylglycerols, CDP-diacylglycerols can have many different combinations of fatty acids of varying lengths and saturation attached at the C-1 and C-2 positions. CDP-DG(16:0/i-19:0), in particular, consists of one hexadecanoyl chain at the C-1 position and one 17-methyloctadecanoyl chain at the C-2 position. In E. coli glycerophospholipid metabolism, the biosynthesis of CDP-diacylglycerol (CDP-DG) involves condensation of phosphatidic acid (PA) and cytidine triphosphate, with elimination of pyrophosphate, catalysed by the enzyme CDP-diacylglycerol synthase. The resulting CDP-diacylglycerol can be utilized immediately for the synthesis of phosphatidylglycerol (PG), and thence cardiolipin (CL), and of phosphatidylinositol (PI). CDP-DG(16:0/i-19:0) is also a substrate of CDP-diacylglycerol pyrophosphatase. It is involved in CDP-diacylglycerol degradation pathway. | |||||||||||||
Structure | ||||||||||||||
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Chemical Formula | C47H87N3O15P2 | |||||||||||||
Average Molecular Weight | 996.167 | |||||||||||||
Monoisotopic Molecular Weight | 995.561243109 | |||||||||||||
IUPAC Name | Not Available | |||||||||||||
Traditional Name | Not Available | |||||||||||||
CAS Registry Number | Not Available | |||||||||||||
SMILES | Not Available | |||||||||||||
InChI Identifier | InChI=1S/C47H87N3O15P2/c1-4-5-6-7-8-9-10-12-16-19-22-25-28-31-42(51)60-35-39(63-43(52)32-29-26-23-20-17-14-11-13-15-18-21-24-27-30-38(2)3)36-61-66(56,57)65-67(58,59)62-37-40-44(53)45(54)46(64-40)50-34-33-41(48)49-47(50)55/h33-34,38-40,44-46,53-54H,4-32,35-37H2,1-3H3,(H,56,57)(H,58,59)(H2,48,49,55)/t39-,40-,44+,45?,46-/m1/s1 | |||||||||||||
InChI Key | UANOYCXOJDRXER-ZTFDZGNXSA-N | |||||||||||||
Chemical Taxonomy | ||||||||||||||
Functional Ontology | ||||||||||||||
Not Available | ||||||||||||||
Physical Properties | ||||||||||||||
State | Expected Solid | |||||||||||||
Predicted Properties | Not Available | |||||||||||||
Spectra | ||||||||||||||
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Cellular Locations | Not Available | |||||||||||||
Biospecimen Locations | Not Available | |||||||||||||
Tissue Locations | Not Available | |||||||||||||
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HMDB ID | Not Available | |||||||||||||
DrugBank ID | Not Available | |||||||||||||
Phenol Explorer Compound ID | Not Available | |||||||||||||
FooDB ID | Not Available | |||||||||||||
KNApSAcK ID | Not Available | |||||||||||||
Chemspider ID | Not Available | |||||||||||||
KEGG Compound ID | Not Available | |||||||||||||
BioCyc ID | Not Available | |||||||||||||
BiGG ID | Not Available | |||||||||||||
Wikipedia Link | Not Available | |||||||||||||
METLIN ID | Not Available | |||||||||||||
PubChem Compound | Not Available | |||||||||||||
PDB ID | Not Available | |||||||||||||
ChEBI ID | Not Available | |||||||||||||
Food Biomarker Ontology | Not Available | |||||||||||||
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Synthesis Reference | Not Available | |||||||||||||
General References |
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