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> Main
CHEBI:65573 - candelalide C
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ChEBI Name
candelalide C
ChEBI ID
CHEBI:65573
Definition
A diterpenoid isolated from
Sesquicillium candelabrum
and has been shown to act as a blocker of the voltage-gated potassium channel Kv1.3.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C28H42O5
Net Charge
0
Average Mass
458.63010
Monoisotopic Mass
458.30322
InChI
InChI=1S/C28H42O5/c1-
16-
9-
10-
21-
27(6,13-
12-
23-
28(21,7)
14-
11-
22(33-
23)
26(4,5)
30)
20(16)
15-
19-
24(29)
17(2)
18(3)
32-
25(19)
31-
8/h20-
23,30H,1,9-
15H2,2-
8H3/t20-
,21-
,22-
,23-
,27-
,28+/m1/s1
InChIKey
JFVQSDWMRIDOHK-RFHSWFGCSA-N
SMILES
[H][C@@]12CC[C@]3(C)[C@H](Cc4c(OC)oc(C)c(C)c4=O)C(=C)CC[C@@]3([H])[C@]1(C)CC[C@@H](O2)C(C)(C)O
Metabolite of Species
Details
Sesquicillium candelabrum
(NCBI:txid180436)
See:
PubMed
Roles Classification
Biological Role
(s):
potassium channel blocker
An agent that inhibits cell membrane glycoproteins that are selectively permeable to potassium ions.
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
candelalide C (
CHEBI:65573
)
has role
metabolite (
CHEBI:25212
)
candelalide C (
CHEBI:65573
)
has role
potassium channel blocker (
CHEBI:50509
)
candelalide C (
CHEBI:65573
)
is a
4-pyranones (
CHEBI:131906
)
candelalide C (
CHEBI:65573
)
is a
cyclic ether (
CHEBI:37407
)
candelalide C (
CHEBI:65573
)
is a
diterpenoid (
CHEBI:23849
)
candelalide C (
CHEBI:65573
)
is a
ketene acetal (
CHEBI:145408
)
candelalide C (
CHEBI:65573
)
is a
organic heterotricyclic compound (
CHEBI:26979
)
candelalide C (
CHEBI:65573
)
is a
tertiary alcohol (
CHEBI:26878
)
IUPAC Name
3-
{[(3
R
,4a
R
,6a
R
,7
R
,10a
R
,10b
S
)-
3-
(2-
hydroxypropan-
2-
yl)-
6a,10b-
dimethyl-
8-
methylidenedodecahydro-
1
H
-
benzo[
f
]chromen-
7-
yl]methyl}-
2-
methoxy-
5,6-
dimethyl-
4
H
-
pyran-
4-
one
Registry Number
Type
Source
8738976
Reaxys Registry Number
Reaxys
Citations
Types
Sources
11430046
PubMed citation
Europe PMC
19191240
PubMed citation
Europe PMC
Last Modified
18 November 2019