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ChEBI
> Main
CHEBI:85005 - anticapsin
Main
ChEBI Ontology
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ChEBI Name
anticapsin
ChEBI ID
CHEBI:85005
Definition
An alanine derivative that is
L
-alanine bearing a 5-oxo-7-oxabicyclo[4.1.0]hept-2-yl substituent at position 3.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C9H13NO4
Net Charge
0
Average Mass
199.20380
Monoisotopic Mass
199.08446
InChI
InChI=1S/C9H13NO4/c10-
5(9(12)
13)
3-
4-
1-
2-
6(11)
8-
7(4)
14-
8/h4-
5,7-
8H,1-
3,10H2,(H,12,13)
/t4-
,5-
,7+,8-
/m0/s1
InChIKey
KHVZXXWDPSCGEK-MGVQOFIGSA-N
SMILES
N[C@@H](C[C@@H]1CCC(=O)[C@@H]2O[C@H]12)C(O)=O
Metabolite of Species
Details
Streptomyces griseoplanus
(NCBI:txid66896)
See:
PubMed
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):
bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
EC 2.6.1.16 (glutamine--fructose-6-phosphate transaminase (isomerizing)) inhibitor
An EC 2.6.1.* (transaminase) inhibitor that interferes with the action of glutamine
fructose-6-phosphate transaminase (isomerizing) (EC 2.6.1.19).
antimetabolite
A substance which is structurally similar to a metabolite but which competes with it or replaces it, and so prevents or reduces its normal utilization.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
anticapsin (
CHEBI:85005
)
has role
antimetabolite (
CHEBI:35221
)
anticapsin (
CHEBI:85005
)
has role
antimicrobial agent (
CHEBI:33281
)
anticapsin (
CHEBI:85005
)
has role
bacterial metabolite (
CHEBI:76969
)
anticapsin (
CHEBI:85005
)
has role
EC 2.6.1.16 (glutamine—fructose-6-phosphate transaminase (isomerizing)) inhibitor (
CHEBI:85011
)
anticapsin (
CHEBI:85005
)
is a
L
-alanine derivative (
CHEBI:83943
)
anticapsin (
CHEBI:85005
)
is a
alicyclic ketone (
CHEBI:36132
)
anticapsin (
CHEBI:85005
)
is a
epoxide (
CHEBI:32955
)
anticapsin (
CHEBI:85005
)
is a
non-proteinogenic
L
-α-amino acid (
CHEBI:83822
)
anticapsin (
CHEBI:85005
)
is tautomer of
anticapsin zwitterion (
CHEBI:84310
)
Incoming
anticapsin zwitterion (
CHEBI:84310
)
is tautomer of
anticapsin (
CHEBI:85005
)
IUPAC Name
3-[(1
R
,2
S
,6
R
)-5-oxo-7-oxabicyclo[4.1.0]hept-2-yl]-
L
-alanine
Synonym
Source
NSC 177854
KNApSAcK
Manual Xref
Database
C00018799
KNApSAcK
View more database links
Registry Numbers
Types
Sources
28978-07-6
CAS Registry Number
ChemIDplus
6370535
Reaxys Registry Number
Reaxys
Citations
Types
Sources
16349914
PubMed citation
Europe PMC
3450099
PubMed citation
Europe PMC
3527630
PubMed citation
Europe PMC
3884731
PubMed citation
Europe PMC
5481496
PubMed citation
Europe PMC
6389459
PubMed citation
Europe PMC
6426523
PubMed citation
Europe PMC
6430854
PubMed citation
Europe PMC
Last Modified
24 February 2015