CHEBI:71169 - succinyladenosine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name succinyladenosine
ChEBI ID CHEBI:71169
Definition An aspartic acid derivative that is L-aspartic acid in which one of the amine hydrogens is substituted by a 9-β-D-ribofuranosyl-9H-purin-6-yl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ChemicalBook:CB0506254, eMolecules:1013946, ZINC000000967570
Download Molfile XML SDF
Formula C14H17N5O8
Net Charge 0
Average Mass 383.31350
Monoisotopic Mass 383.10771
InChI InChI=1S/C14H17N5O8/c20-2-6-9(23)10(24)13(27-6)19-4-17-8-11(15-3-16-12(8)19)18-5(14(25)26)1-7(21)22/h3-6,9-10,13,20,23-24H,1-2H2,(H,21,22)(H,25,26)(H,15,16,18)/t5-,6+,9+,10+,13+/m0/s1
InChIKey VKGZCEJTCKHMRL-VWJPMABRSA-N
SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H](CC(O)=O)C(O)=O)ncnc12
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing succinyladenosine (CHEBI:71169) has functional parent adenosine (CHEBI:16335)
succinyladenosine (CHEBI:71169) has functional parent succinic acid (CHEBI:15741)
succinyladenosine (CHEBI:71169) has role metabolite (CHEBI:25212)
succinyladenosine (CHEBI:71169) is a L-aspartic acid derivative (CHEBI:83978)
succinyladenosine (CHEBI:71169) is a adenosines (CHEBI:22260)
succinyladenosine (CHEBI:71169) is a amino dicarboxylic acid (CHEBI:36164)
succinyladenosine (CHEBI:71169) is conjugate acid of succinyladenosine anion (CHEBI:133523)
Incoming succinyladenosine anion (CHEBI:133523) is conjugate base of succinyladenosine (CHEBI:71169)
IUPAC Name
(2S)-2-({9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-9H-purin-6-yl}amino)butanedioic acid
Synonyms Sources
(S)-N-(1,2-dicarboxyethyl)-Adenosine HMDB
6-(1,2-Dicarboxyethylamino)-9-β-D-ribofuranosylpurine HMDB
N-(9-β-D-ribofuranosyl-9H-purin-6-yl)-L-aspartic acid ChemIDplus
N-9-Ribofuranosyl-9H-purin-6-yl-Aspartic acid HMDB
Succinoadenosine HMDB
Manual Xref Database
HMDB0000912 HMDB
View more database links
Registry Numbers Types Sources
100051 Reaxys Registry Number Reaxys
4542-23-8 CAS Registry Number ChemIDplus
Citation Type Source
22770225 PubMed citation Europe PMC
Last Modified
29 September 2016