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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:133621 - valanimycin
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ChEBI Ontology
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ChEBI Name
valanimycin
ChEBI ID
CHEBI:133621
Definition
An azoxy compound that is acrylic acid in which the olefinic hydrogen at position 2 has been replaced by an isobutyl-
O
N
N
-azoxy group.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Kristian Axelsen
Supplier Information
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Formula
C7H12N2O3
Net Charge
0
Average Mass
172.182
Monoisotopic Mass
172.08479
InChI
InChI=1S/C7H12N2O3/c1-5(2)4-9(12)8-6(3)7(10)11/h5H,3-4H2,1-2H3,(H,10,11)/b9-8-
InChIKey
DTXMRELKPKEPSO-HJWRWDBZSA-N
SMILES
CC(C/[N+](=N/C(C(O)=O)=C)/[O-])C
Metabolite of Species
Details
Streptomyces viridifaciens
(NCBI:txid48665)
of strain MG456-hF10 See:
PubMed
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Biological Role
(s):
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
valanimycin (
CHEBI:133621
)
has functional parent
acrylic acid (
CHEBI:18308
)
valanimycin (
CHEBI:133621
)
has role
antimicrobial agent (
CHEBI:33281
)
valanimycin (
CHEBI:133621
)
has role
bacterial metabolite (
CHEBI:76969
)
valanimycin (
CHEBI:133621
)
is a
α,β-unsaturated monocarboxylic acid (
CHEBI:79020
)
valanimycin (
CHEBI:133621
)
is a
azoxy compound (
CHEBI:37390
)
IUPAC Name
2-[(2-methylpropyl)-
O
N
N
-azoxy]prop-2-enoic acid
Synonyms
Sources
2-(Isobutyl-(ONN)azoxy)acrylic acid
ChemIDplus
2-[(2-methylpropyl)-
O
N
N
-azoxy]acrylic acid
ChEBI
Manual Xref
Database
C00017752
KNApSAcK
View more database links
Registry Numbers
Types
Sources
101961-60-8
CAS Registry Number
ChemIDplus
21142834
Reaxys Registry Number
Reaxys
Citations
Types
Sources
12406225
PubMed citation
Europe PMC
12688722
PubMed citation
Europe PMC
16857674
PubMed citation
Europe PMC
18451033
PubMed citation
SUBMITTER
19548668
PubMed citation
Europe PMC
19892763
PubMed citation
Europe PMC
28060488
PubMed citation
Europe PMC
3754251
PubMed citation
Europe PMC
Last Modified
20 February 2017