CHEBI:191409 - ADP-β-D-ribose

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name ADP-β-D-ribose
ChEBI ID CHEBI:191409
ChEBI ASCII Name ADP-beta-D-ribose
Definition An ADP-D-ribose with α configuration at the anomeric centre.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
more structures >>
Formula C15H23N5O14P2
Net Charge 0
Average Mass 559.318
Monoisotopic Mass 559.07167
InChI InChI=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
InChIKey SRNWOUGRCWSEMX-KEOHHSTQSA-N
SMILES NC1=C2N=CN([C@@H]3O[C@H](COP(O)(=O)OP(O)(=O)OC[C@H]4O[C@@H](O)[C@H](O)[C@@H]4O)[C@@H](O)[C@H]3O)C2=NC=N1
Roles Classification
Biological Role(s): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
(via ADP-D-ribose )
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
(via ADP-D-ribose )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing ADP-β-D-ribose (CHEBI:191409) is a ADP-D-ribose (CHEBI:16960)
Incoming cyclic ADP-β-D-ribose (CHEBI:31445) has functional parent ADP-β-D-ribose (CHEBI:191409)
IUPAC Name
adenosine 5'-[3-(β-D-ribofuranos-5-O-yl) dihydrogen diphosphate]
Synonym Source
[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl [(2R,3S,4R,5R)-3,4,5-trihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate IUPAC
Manual Xref Database
APR PDBeChem
View more database links
Last Modified
16 January 2023