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ChEBI
> Main
CHEBI:68249 - platencin A
1
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ChEBI Name
platencin A
1
ChEBI ID
CHEBI:68249
ChEBI ASCII Name
platencin A1
Definition
A polycyclic cage that is the 9-hydroxy derivative of platencin. It is isolated from
Streptomyces platensis
.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C24H27NO7
Net Charge
0
Average Mass
441.47370
Monoisotopic Mass
441.17875
InChI
InChI=1S/C24H27NO7/c1-
12-
11-
24-
8-
5-
17(27)
23(2,16(24)
9-
13(12)
10-
18(24)
28)
7-
6-
19(29)
25-
20-
15(26)
4-
3-
14(21(20)
30)
22(31)
32/h3-
5,8,13,16,18,26,28,30H,1,6-
7,9-
11H2,2H3,(H,25,29)
(H,31,32)
/t13-
,16+,18-
,23+,24+/m1/s1
InChIKey
KCPPASJQWABQQM-XLJNEENLSA-N
SMILES
[H][C@@]12C[C@@H](O)[C@]3(CC1=C)C=CC(=O)[C@@](C)(CCC(=O)Nc1c(O)ccc(C(O)=O)c1O)[C@]3([H])C2
Metabolite of Species
Details
Streptomyces platensis
(NCBI:txid58346)
of strain MA7327 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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
platencin A
1
(
CHEBI:68249
)
has functional parent
platencin (
CHEBI:68241
)
platencin A
1
(
CHEBI:68249
)
has role
bacterial metabolite (
CHEBI:76969
)
platencin A
1
(
CHEBI:68249
)
is a
aromatic amide (
CHEBI:62733
)
platencin A
1
(
CHEBI:68249
)
is a
cyclic ketone (
CHEBI:3992
)
platencin A
1
(
CHEBI:68249
)
is a
dihydroxybenzoic acid (
CHEBI:23778
)
platencin A
1
(
CHEBI:68249
)
is a
monocarboxylic acid amide (
CHEBI:29347
)
platencin A
1
(
CHEBI:68249
)
is a
polycyclic cage (
CHEBI:33640
)
platencin A
1
(
CHEBI:68249
)
is a
secondary alcohol (
CHEBI:35681
)
Incoming
platencin A
1
methyl ester (
CHEBI:68250
)
has functional parent
platencin A
1
(
CHEBI:68249
)
IUPAC Name
2,4-
dihydroxy-
3-
({3-
[(2
R
,4a
R
,8
S
,8a
R
,9
R
)-
9-
hydroxy-
8-
methyl-
3-
methylidene-
7-
oxo-
1,3,4,7,8,8a-
hexahydro-
2
H
-
2,4a-
ethanonaphthalen-
8-
yl]propanoyl}amino)benzoic acid
Registry Number
Type
Source
20696045
Reaxys Registry Number
Reaxys
Citation
Type
Source
21214253
PubMed citation
Europe PMC
Last Modified
06 March 2014