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CHEBI:69729 - Euphorbia substance SPr 5
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ChEBI Name
Euphorbia substance SPr 5
ChEBI ID
CHEBI:69729
Definition
A natural product found in
Euphorbia prolifera
.
Stars
This entity has been manually annotated by a third party.
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Formula
C34H48O6
Net Charge
0
Average Mass
552.74130
Monoisotopic Mass
552.34509
InChI
InChI=1S/C34H48O6/c1-
8-
9-
10-
11-
12-
13-
14-
15-
16-
39-
30-
23(5)
33(38)
26-
17-
22(4)
28(36)
25(26)
18-
24(20-
35)
19-
27(33)
29-
32(6,7)
34(29,30)
40-
31(37)
21(2)
3/h10-
15,17,19,21,23,25-
27,29-
30,35,38H,8-
9,16,18,20H2,1-
7H3/b11-
10+,13-
12+,15-
14-
/t23-
,25+,26-
,27+,29-
,30-
,33+,34-
/m1/s1
InChIKey
NKOQECBSAYYRBF-NTAHFFFWSA-N
SMILES
[H]
[C@]
12CC(CO)
=C[C@@]
3([H]
)
[C@]
4([H]
)
C(C)
(C)
[C@]
4(OC(=O)
C(C)
C)
[C@H]
(OC\C=C/C=C/C=C/CCC)
[C@@H]
(C)
[C@]
3(O)
[C@]
1([H]
)
C=C(C)
C2=O
Metabolite of Species
Details
Euphorbia prolifera
(IPNI:347888-1)
Found in root
(BTO:0001188)
. Ethyl acetate soluble part of methanol extract of air-dried roots. 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
Euphorbia substance SPr 5 (
CHEBI:69729
)
has role
metabolite (
CHEBI:25212
)
Euphorbia substance SPr 5 (
CHEBI:69729
)
is a
diterpenoid (
CHEBI:23849
)
Citation
Type
Source
21928782
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:tertiary alcohol(CHEBI:26878); ISA:ketone(CHEBI:17087); ISA:carboxylic ester(CHEBI:33308); ISA:organic hydroxy compound(CHEBI:33822); ISA:ether(CHEBI:25698); ISA:organonitrogen compound(CHEBI:35352); ISA:monocarboxylic acid(CHEBI:25384); ISA:primary alcohol(CHEBI:15734);