Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-11-18 00:04:20 UTC
Update Date2024-04-30 19:45:21 UTC
Metabolite IDMMDBc0030342
Metabolite Identification
Common NamedADP
DescriptionDeoxyadenosine diphosphate is a nucleoside diphosphate. It is related to the common nucleic acid ATP, or adenosine triphosphate, with the -OH (hydroxyl) group on the 2' carbon on the nucleotide's pentose removed (hence the deoxy- part of the name), and with one fewer phosphoryl group than ATP.
Structure
Synonyms
ValueSource
2'-Deoxyadenosine-5'-diphosphateHMDB
Deoxyadenosine diphosphateHMDB
Molecular FormulaC10H15N5O9P2
Average Mass411.2017
Monoisotopic Mass411.034500127
IUPAC Name[({[(2R,3S)-5-(6-amino-9H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]phosphonic acid
Traditional Name{[(2R,3S)-5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy(hydroxy)phosphoryl}oxyphosphonic acid
CAS Registry NumberNot Available
SMILES
NC1=NC=NC2=C1N=CN2C1C[C@H](O)[C@@H](COP(O)(=O)OP(O)(O)=O)O1
InChI Identifier
InChI=1S/C10H15N5O9P2/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(16)6(23-7)2-22-26(20,21)24-25(17,18)19/h3-7,16H,1-2H2,(H,20,21)(H2,11,12,13)(H2,17,18,19)/t5-,6+,7?/m0/s1
InChI KeyDAEAPNUQQAICNR-GFCOJPQKSA-N