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> Main
CHEBI:69824 - ent-13S-hydroxy-16-atisene-3,14-dione
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ChEBI Ontology
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ChEBI Name
ent-13S-hydroxy-16-atisene-3,14-dione
ChEBI ID
CHEBI:69824
Definition
A natural product found in
Euphorbia fischeriana
.
Stars
This entity has been manually annotated by a third party.
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Formula
C20H28O3
Net Charge
0
Average Mass
316.43450
Monoisotopic Mass
316.20384
InChI
InChI=1S/C20H28O3/c1-
11-
10-
20-
8-
5-
13-
18(2,3)
15(21)
6-
7-
19(13,4)
14(20)
9-
12(11)
16(22)
17(20)
23/h12-
14,16,22H,1,5-
10H2,2-
4H3/t12-
,13+,14-
,16-
,19+,20-
/m0/s1
InChIKey
UQKJSKXVMBIKGF-KIINSAQZSA-N
SMILES
[H][C@]12C[C@@]3([H])[C@]4(C)CCC(=O)C(C)(C)[C@@]4([H])CC[C@@]3(CC1=C)C(=O)[C@H]2O
Metabolite of Species
Details
Euphorbia fischeriana
(NCBI:txid1035560)
Found in whole plant
(BTO:0001461)
. 90% EtOH extract of dried and powdered plant 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
ent-13S-hydroxy-16-atisene-3,14-dione (
CHEBI:69824
)
has parent hydride
atisane (
CHEBI:36471
)
ent-13S-hydroxy-16-atisene-3,14-dione (
CHEBI:69824
)
has role
metabolite (
CHEBI:25212
)
ent-13S-hydroxy-16-atisene-3,14-dione (
CHEBI:69824
)
is a
diterpenoid (
CHEBI:23849
)
Synonym
Source
(5beta,8alpha,9beta,10alpha,12alpha,13S)-13-Hydroxyatis-16-ene-3,14-dione
ChEBI
Citation
Type
Source
21534540
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:cyclohexanones(CHEBI:23482); ISA:secondary alcohol(CHEBI:35681); ISA:organic hydroxy compound(CHEBI:33822);