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ChEBI
> Main
CHEBI:68257 - platensic acid methyl ester
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ChEBI Name
platensic acid methyl ester
ChEBI ID
CHEBI:68257
Definition
A polycyclic cage that is the methyl ester derivative of platensic acid. It is isolated from
Streptomyces platensis
.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C18H24O4
Net Charge
0
Average Mass
304.38080
Monoisotopic Mass
304.16746
InChI
InChI=1S/C18H24O4/c1-
16(6-
5-
14(20)
21-
3)
13(19)
4-
7-
18-
9-
11-
8-
12(15(16)
18)
22-
17(11,2)
10-
18/h4,7,11-
12,15H,5-
6,8-
10H2,1-
3H3/t11-
,12+,15+,16-
,17+,18+/m1/s1
InChIKey
NUIVTFDVMXNHQW-URWOFZPHSA-N
SMILES
[H][C@]12C[C@]3([H])O[C@@]1(C)C[C@@]1(C2)C=CC(=O)[C@@](C)(CCC(=O)OC)[C@]31[H]
Metabolite of Species
Details
Streptomyces platensis
(NCBI:txid58346)
of strain MA7327 See:
PubMed
Roles Classification
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
platensic acid methyl ester (
CHEBI:68257
)
has functional parent
platensic acid (
CHEBI:68256
)
platensic acid methyl ester (
CHEBI:68257
)
has role
metabolite (
CHEBI:25212
)
platensic acid methyl ester (
CHEBI:68257
)
is a
cyclic ether (
CHEBI:37407
)
platensic acid methyl ester (
CHEBI:68257
)
is a
cyclic ketone (
CHEBI:3992
)
platensic acid methyl ester (
CHEBI:68257
)
is a
methyl ester (
CHEBI:25248
)
platensic acid methyl ester (
CHEBI:68257
)
is a
polycyclic cage (
CHEBI:33640
)
IUPAC Name
methyl 3-
[(1
S
,4a
S
,6
S
,7
S
,9
S
,9a
R
)-
1,6-
dimethyl-
2-
oxo-
1,2,5,6,7,8,9,9a-
octahydro-
6,9-
epoxy-
4a,7-
methanobenzo[7]annulen-
1-
yl]propanoate
Synonym
Source
methyl platensinoate
ChEBI
Registry Number
Type
Source
19006908
Reaxys Registry Number
Reaxys
Citations
Types
Sources
19874023
PubMed citation
Europe PMC
21214253
PubMed citation
Europe PMC
Last Modified
06 March 2015