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> Main
CHEBI:66136 - kalimantacin B
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ChEBI Name
kalimantacin B
ChEBI ID
CHEBI:66136
Definition
A fatty acid derivative isolated from the fermentation broth of
Alcaligenes sp.
YL-02632S. It is an antibiotic with antibacterial activity.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C30H48N2O7
Net Charge
0
Average Mass
548.71130
Monoisotopic Mass
548.34615
InChI
InChI=1S/C30H48N2O7/c1-
20(14-
22(3)
15-
23(4)
17-
28(35)
36)
12-
10-
8-
7-
9-
11-
13-
21(2)
16-
26(33)
18-
27(34)
19-
32-
29(37)
24(5)
25(6)
39-
30(31)
38/h7-
9,11,17,21-
22,24-
25,27,34H,1,10,12-
16,18-
19H2,2-
6H3,(H2,31,38)
(H,32,37)
(H,35,36)
/b8-
7+,11-
9+,23-
17+
InChIKey
GENAAYFYLGYPIQ-FFPWVZAVSA-N
SMILES
CC(C\C=C\C=C\CCC(=C)CC(C)C\C(C)=C\C(O)=O)CC(=O)CC(O)CNC(=O)C(C)C(C)OC(N)=O
Metabolite of Species
Details
Alcaligenes
sp.
(NCBI:txid512)
of strain YL 02632S 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):
bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
antibacterial agent
A substance (or active part thereof) that kills or slows the growth of bacteria.
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
kalimantacin B (
CHEBI:66136
)
has role
antibacterial agent (
CHEBI:33282
)
kalimantacin B (
CHEBI:66136
)
has role
antimicrobial agent (
CHEBI:33281
)
kalimantacin B (
CHEBI:66136
)
has role
bacterial metabolite (
CHEBI:76969
)
kalimantacin B (
CHEBI:66136
)
is a
α,β-unsaturated monocarboxylic acid (
CHEBI:79020
)
kalimantacin B (
CHEBI:66136
)
is a
carbamate ester (
CHEBI:23003
)
kalimantacin B (
CHEBI:66136
)
is a
fatty acid derivative (
CHEBI:61697
)
kalimantacin B (
CHEBI:66136
)
is a
secondary carboxamide (
CHEBI:140325
)
IUPAC Name
(2
E
,10
E
,12
E
)-
20-
{[3-
(carbamoyloxy)-
2-
methylbutanoyl]amino}-
19-
hydroxy-
3,5,15-
trimethyl-
7-
methylidene-
17-
oxoicosa-
2,10,12-
trienoic acid
Registry Number
Type
Source
21369092
Reaxys Registry Number
Reaxys
Citation
Type
Source
8621352
PubMed citation
Europe PMC
Last Modified
07 March 2018