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ChEBI
> Main
CHEBI:177894 - clavaphyllene
Main
ChEBI Ontology
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ChEBI Name
clavaphyllene
ChEBI ID
CHEBI:177894
Definition
A sesterterpene that is produced by a fungal chimeric terpene synthase, PTTS051.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Tereza Calounova
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Formula
C25H40
Net Charge
0
Average Mass
340.595
Monoisotopic Mass
340.31300
InChI
InChI=1S/C25H40/c1-
19(2)
10-
7-
11-
20(3)
13-
9-
17-
25(6)
18-
23-
22(5)
14-
8-
12-
21(4)
15-
16-
24(23)
25/h10,12-
13,23-
24H,5,7-
9,11,14-
18H2,1-
4,6H3/b20-
13+,21-
12+/t23-
,24-
,25-
/m1/s1
InChIKey
KEWHXPJNBRKPIV-YCRSHSPUSA-N
SMILES
[H][C@]12C[C@@](C)(CC\C=C(/C)CCC=C(C)C)[C@]1([H])CC\C(C)=C\CCC2=C
Metabolite of Species
Details
Pestalotiopsis fici
(NCBI:txid393283)
See:
PubMed
Aspergillus clavatus
(NCBI:txid5057)
See:
PubMed
Roles Classification
Biological Role
(s):
fungal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
Aspergillus metabolite
Any fungal metabolite produced during a metabolic reaction in the mould,
Aspergillus
.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
clavaphyllene (
CHEBI:177894
)
has role
Aspergillus
metabolite (
CHEBI:76956
)
clavaphyllene (
CHEBI:177894
)
has role
fungal metabolite (
CHEBI:76946
)
clavaphyllene (
CHEBI:177894
)
is a
carbobicyclic compound (
CHEBI:36785
)
clavaphyllene (
CHEBI:177894
)
is a
polycyclic olefin (
CHEBI:35714
)
clavaphyllene (
CHEBI:177894
)
is a
sesterterpene (
CHEBI:35192
)
IUPAC Name
(1
R
,4
E
,9
S
,11
R
)-
11-
[(3
E
)-
4,8-
dimethylnona-
3,7-
dien-
1-
yl]-
4,11-
dimethyl-
8-
methylidenebicyclo[7.2.0]undec-
4-
ene
Citations
Types
Sources
23324037
PubMed citation
Europe PMC
34257153
PubMed citation
SUBMITTER
Last Modified
20 August 2021