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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:69915 - Euphodendriane A, (rel)-
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ChEBI Ontology
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ChEBI Name
Euphodendriane A, (rel)-
ChEBI ID
CHEBI:69915
Definition
A natural product found in
Euphorbia dendroides
.
Stars
This entity has been manually annotated by a third party.
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Formula
C31H38O7
Net Charge
0
Average Mass
522.62920
Monoisotopic Mass
522.26175
InChI
InChI=1S/C31H38O7/c1-
15(2)
27(34)
38-
31-
25(29(31,6)
7)
21-
14-
17(4)
24(33)
22-
20(13-
16(3)
23(22)
32)
30(21,36)
18(5)
26(31)
37-
28(35)
19-
11-
9-
8-
10-
12-
19/h8-
15,18,20-
22,24-
26,33,36H,1-
7H3/t18-
,20-
,21+,22-
,24-
,25-
,26-
,30+,31-
/m1/s1
InChIKey
TUYMOSZNDXCMQM-GLPNJXFDSA-N
SMILES
[H]
[C@@]
12[C@H]
(O)
C(C)
=C[C@@]
3([H]
)
[C@]
4([H]
)
C(C)
(C)
[C@]
4(OC(=O)
C(C)
C)
[C@H]
(OC(=O)
c4ccccc4)
[C@@H]
(C)
[C@]
3(O)
[C@]
1([H]
)
C=C(C)
C2=O
Metabolite of Species
Details
Euphorbia dendroides
(NCBI:txid38845)
Found in aerial part
(BTO:0001658)
. 60% aqueous ethanol extract of Dried plant material 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
Euphodendriane A, (rel)- (
CHEBI:69915
)
has role
metabolite (
CHEBI:25212
)
Euphodendriane A, (rel)- (
CHEBI:69915
)
is a
diterpenoid (
CHEBI:23849
)
Citation
Type
Source
21707046
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:benzoate ester(CHEBI:36054); ISA:benzyl ether(CHEBI:59859); ISA:carbonyl compound(CHEBI:36586); ISA:dicarboxylic acid(CHEBI:35692); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:tertiary alcohol(CHEBI:26878); ISA:carboxylic ester(CHEBI:33308); ISA:organic hydroxy compound(CHEBI:33822); ISA:ketone(CHEBI:17087); ISA:secondary alcohol(CHEBI:35681); ISA:organonitrogen compound(CHEBI:35352); ISA:ether(CHEBI:25698); ISA:organic heterocyclic compound(CHEBI:24532);