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ChEBI
> Main
CHEBI:69658 - Athrolide A
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ChEBI Ontology
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ChEBI Name
Athrolide A
ChEBI ID
CHEBI:69658
Definition
A natural product found in
Athroisma proteiforme
.
Stars
This entity has been manually annotated by a third party.
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Formula
C23H32O8
Net Charge
0
Average Mass
436.49540
Monoisotopic Mass
436.20972
InChI
InChI=1S/C23H32O8/c1-
10(2)
21(26)
31-
16-
9-
17(28-
13(5)
24)
23(7)
19(16)
11(3)
8-
15-
18(12(4)
22(27)
30-
15)
20(23)
29-
14(6)
25/h10-
11,15-
20H,4,8-
9H2,1-
3,5-
7H3/t11-
,15+,16+,17-
,18-
,19-
,20+,23-
/m1/s1
InChIKey
NDMSWUKPDPLPAZ-WDPXAWCQSA-N
SMILES
[H]
[C@]
12C[C@@H]
(C)
[C@]
3([H]
)
[C@H]
(C[C@@H]
(OC(C)
=O)
[C@@]
3(C)
[C@@H]
(OC(C)
=O)
[C@]
1([H]
)
C(=C)
C(=O)
O2)
OC(=O)
C(C)
C
Metabolite of Species
Details
Athroisma proteiforme
(IPNI:182889-1)
Found in aerial part
(BTO:0001658)
. Ethyl alcohol extract of dried, ground aerial parts. 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
Athrolide A (
CHEBI:69658
)
has role
metabolite (
CHEBI:25212
)
Athrolide A (
CHEBI:69658
)
is a
sesquiterpene lactone (
CHEBI:37667
)
Synonym
Source
(1S,2S,4R,5S,6S,7R,8S,10R)-2-(2-methylpropanoyloxy)-4-acetoxy-6-acetoxyguai-11(13)-en-8,12-olide
ChEBI
Citation
Type
Source
21995542
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:sesquiterpene lactone(CHEBI:37667); ISA:sesquiterpenoid(CHEBI:26658); HPH:ambrosane(CHEBI:35712); ISA:gamma-lactone(CHEBI:37581); ISA:dicarboxylic acid(CHEBI:35692); ISA:enoate ester(CHEBI:51702); ISA:oxolanes(CHEBI:26912); ISA:organonitrogen compound(CHEBI:35352); ISA:ether(CHEBI:25698); ISA:carbonyl compound(CHEBI:36586);