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ChEBI
> Main
CHEBI:71169 - succinyladenosine
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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-9
H
-purin-6-yl group.
Stars
This entity has been manually annotated by the ChEBI Team.
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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 (Br
o
nsted acid).
(via
organic amino compound
)
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted 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
(2
S
)-
2-
({9-
[(2
R
,3
R
,4
S
,5
R
)-
3,4-
dihydroxy-
5-
(hydroxymethyl)tetrahydrofuran-
2-
yl]-
9
H
-
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-
9
H
-
purin-
6-
yl)-
L
-
aspartic acid
ChemIDplus
N
-9-Ribofuranosyl-9
H
-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