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> Main
CHEBI:67481 - ethyl lansiolate
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ChEBI Name
ethyl lansiolate
ChEBI ID
CHEBI:67481
Definition
A triterpenoid that is the ethyl ester of lansiolic acid. It has been isolated from the twigs of
Lansium domesticum
.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C32H52O3
Net Charge
0
Average Mass
484.75350
Monoisotopic Mass
484.39165
InChI
InChI=1S/C32H52O3/c1-
10-
35-
29(34)
18-
20-
31(8)
24(21(2)
3)
13-
11-
22(4)
25(31)
14-
15-
26-
23(5)
12-
16-
27-
30(6,7)
28(33)
17-
19-
32(26,27)
9/h11,24-
28,33H,2,5,10,12-
20H2,1,3-
4,6-
9H3/t24-
,25-
,26-
,27-
,28-
,31-
,32+/m0/s1
InChIKey
MBFTWDFKACXAAV-XXYMEPQGSA-N
SMILES
CCOC(=O)CC[C@@]1(C)[C@@H](CC=C(C)[C@@H]1CC[C@H]1C(=C)CC[C@H]2C(C)(C)[C@@H](O)CC[C@]12C)C(C)=C
Metabolite of Species
Details
Lansium domesticum
(NCBI:txid201017)
Found in twig
(BTO:0001411)
. 95% ethanolic extract of air-dried and powdered twigs 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.
antibacterial agent
A substance (or active part thereof) that kills or slows the growth of bacteria.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
ethyl lansiolate (
CHEBI:67481
)
has functional parent
lansiolic acid (
CHEBI:67483
)
ethyl lansiolate (
CHEBI:67481
)
has role
antibacterial agent (
CHEBI:33282
)
ethyl lansiolate (
CHEBI:67481
)
has role
metabolite (
CHEBI:25212
)
ethyl lansiolate (
CHEBI:67481
)
has role
plant metabolite (
CHEBI:76924
)
ethyl lansiolate (
CHEBI:67481
)
is a
ethyl ester (
CHEBI:23990
)
ethyl lansiolate (
CHEBI:67481
)
is a
secondary alcohol (
CHEBI:35681
)
ethyl lansiolate (
CHEBI:67481
)
is a
triterpenoid (
CHEBI:36615
)
IUPAC Name
ethyl 3-
[(1
S
,2
S
,6
S
)-
2-
{2-
[(1
S
,4a
R
,6
S
,8a
R
)-
6-
hydroxy-
5,5,8a-
trimethyl-
2-
methylidenedecahydronaphthalen-
1-
yl]ethyl}-
1,3-
dimethyl-
6-
(prop-
1-
en-
2-
yl)cyclohex-
3-
en-
1-
yl]propanoate
Registry Number
Type
Source
21534275
Reaxys Registry Number
Reaxys
Citation
Type
Source
21401117
PubMed citation
Europe PMC
Last Modified
02 March 2015