EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:16960 - ADP-D-ribose

ChEBI IDCHEBI:16960
ChEBI NameADP-D-ribose
Stars
ASCII NameADP-D-ribose
DefinitionA nucleotide-sugar having ADP as the nucleotide fragment and D-ribofuranos-5-yl as the sugar component.
Secondary ChEBI IDsCHEBI:2351, CHEBI:13231, CHEBI:20850, CHEBI:32889, CHEBI:40752
Last Modified12 May 2022
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC15H23N5O14P2
Net Charge0
Average Mass559.318
Monoisotopic Mass559.07167
SMILESNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]2OC(O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O
InChIInChI=1S/C15H23N5O14P2/c16-12-7-13(18-3-17-12)20(4-19-7)14-10(23)8(21)5(32-14)1-30-35(26,27)34-36(28,29)31-2-6-9(22)11(24)15(25)33-6/h3-6,8-11,14-15,21-25H,1-2H2,(H,26,27)(H,28,29)(H2,16,17,18)/t5-,6-,8-,9-,10-,11-,14-,15?/m1/s1
InChIKeySRNWOUGRCWSEMX-TYASJMOZSA-N
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Biological Roles:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
ADP-D-ribose (CHEBI:16960) has functional parent ADP (CHEBI:16761)
ADP-D-ribose (CHEBI:16960) has role Escherichia coli metabolite (CHEBI:76971)
ADP-D-ribose (CHEBI:16960) has role mouse metabolite (CHEBI:75771)
ADP-D-ribose (CHEBI:16960) is a ADP-sugar (CHEBI:35239)
ADP-D-ribose (CHEBI:16960) is conjugate acid of ADP-D-ribose(2−) (CHEBI:57967)
Incoming Relation(s)
N4-(ADP-ribosyl)-L-asparagine (CHEBI:21832) has functional parent ADP-D-ribose (CHEBI:16960)
Nτ-(ADP-D-ribosyl)-L-histidyl(2−) residue (CHEBI:191398) has functional parent ADP-D-ribose (CHEBI:16960)
Nω-(ADP-D-ribosyl)-L-arginine (CHEBI:15827) has functional parent ADP-D-ribose (CHEBI:16960)
O-(ADP-ribosyl)-L-serine (CHEBI:21924) has functional parent ADP-D-ribose (CHEBI:16960)
S-(ADP-ribosyl)-L-cysteine (CHEBI:22020) has functional parent ADP-D-ribose (CHEBI:16960)
L-glutamyl-5-poly(ADP-ribose) (CHEBI:21315) has functional parent ADP-D-ribose (CHEBI:16960)
2''-O-glutaryl-ADP-D-ribose (CHEBI:88141) has functional parent ADP-D-ribose (CHEBI:16960)
2''-O-malonyl-ADP-D-ribose (CHEBI:88146) has functional parent ADP-D-ribose (CHEBI:16960)
2''-O-succinyl-ADP-D-ribose (CHEBI:88145) has functional parent ADP-D-ribose (CHEBI:16960)
poly-ADP-D-ribose (CHEBI:61151) has part ADP-D-ribose (CHEBI:16960)
ADP-α-D-ribose (CHEBI:191408) is a ADP-D-ribose (CHEBI:16960)
ADP-β-D-ribose (CHEBI:191409) is a ADP-D-ribose (CHEBI:16960)
ADP-D-ribose(2−) (CHEBI:57967) is conjugate base of ADP-D-ribose (CHEBI:16960)
IUPAC Name 
adenosine 5'-[3-(D-ribofuranos-5-O-yl) dihydrogen diphosphate]
Synonyms  Source
ADPriboseKEGG COMPOUND
ADP-ribosesChEBI
adenosine diphosphate riboseChemIDplus
ADP riboseChemIDplus
adenosine 5'-diphosphoriboseChemIDplus
ribose adenosinediphosphateDrugBank
Manual XrefsDatabases
C00301KEGG COMPOUND
Registry NumbersSources
Beilstein:1236193Beilstein
Beilstein:6081768Beilstein
CAS:20762-30-5ChemIDplus