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> Main
CHEBI:68103 - 3-epioleanolic acid
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ChEBI Name
3-epioleanolic acid
ChEBI ID
CHEBI:68103
Definition
A natural product found in
Radermachera boniana
.
Stars
This entity has been manually annotated by a third party.
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Formula
C30H48O3
Net Charge
0
Average Mass
456.70030
Monoisotopic Mass
456.36035
InChI
InChI=1S/C30H48O3/c1-
25(2)
14-
16-
30(24(32)
33)
17-
15-
28(6)
19(20(30)
18-
25)
8-
9-
22-
27(5)
12-
11-
23(31)
26(3,4)
21(27)
10-
13-
29(22,28)
7/h8,20-
23,31H,9-
18H2,1-
7H3,(H,32,33)
/t20-
,21-
,22+,23+,27-
,28+,29+,30-
/m0/s1
InChIKey
MIJYXULNPSFWEK-KDQGZELNSA-N
SMILES
[H]
[C@@]
12CC(C)
(C)
CC[C@@]
1(CC[C@]
1(C)
C2=CC[C@]
2([H]
)
[C@@]
3(C)
CC[C@@H]
(O)
C(C)
(C)
[C@]
3([H]
)
CC[C@@]
12C)
C(O)
=O
Metabolite of Species
Details
Radermachera boniana
(IPNI:110489-1)
Found in leaf
(BTO:0000713)
. Ethylacetate extract of dried and ground mixture of twigs and leaves See:
PubMed
Radermachera boniana
(IPNI:110489-1)
Found in twig
(BTO:0001411)
. Ethylacetate extract of dried and ground mixture of twigs and leaves 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
3-epioleanolic acid (
CHEBI:68103
)
has role
metabolite (
CHEBI:25212
)
3-epioleanolic acid (
CHEBI:68103
)
is a
triterpenoid (
CHEBI:36615
)
Synonym
Source
(3alpha)-3-hydroxyolean-12-en-28-oic acid
ChEBI
Manual Xref
Database
HMDB0036962
HMDB
View more database links
Citation
Type
Source
21469696
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:secondary alcohol(CHEBI:35681); ISA:organic hydroxy compound(CHEBI:33822); ISA:monocarboxylic acid(CHEBI:25384); ISA:organonitrogen compound(CHEBI:35352); ISA:carboxylic acid(CHEBI:33575); ISA:carbonyl compound(CHEBI:36586);