Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:69344 - 8-epiinuviscolide
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
8-epiinuviscolide
ChEBI ID
CHEBI:69344
Definition
A sesquiterpene lactone that is the
C
-8 epimer of inuviscolide. It has been isolated from the aerial parts of
Inula hupehensis
.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C15H20O3
Net Charge
0
Average Mass
248.31750
Monoisotopic Mass
248.14124
InChI
InChI=1S/C15H20O3/c1-
8-
6-
13-
11(9(2)
14(16)
18-
13)
7-
12-
10(8)
4-
5-
15(12,3)
17/h10-
13,17H,1-
2,4-
7H2,3H3/t10-
,11-
,12-
,13-
,15-
/m1/s1
InChIKey
GTYUWNQOOLJZBM-FTQJZPFOSA-N
SMILES
C[C@@]1(O)CC[C@H]2[C@H]1C[C@H]1[C@@H](CC2=C)OC(=O)C1=C
Metabolite of Species
Details
Inula hupehensis
(IPNI:225932-1)
Found in aerial part
(BTO:0001658)
. 95% aqueous EtOH extract of dried and powdered aerial parts See:
PubMed
Roles Classification
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Application
(s):
anti-inflammatory agent
Any compound that has anti-inflammatory effects.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
8-epiinuviscolide (
CHEBI:69344
)
has role
anti-inflammatory agent (
CHEBI:67079
)
8-epiinuviscolide (
CHEBI:69344
)
has role
plant metabolite (
CHEBI:76924
)
8-epiinuviscolide (
CHEBI:69344
)
is a
γ-lactone (
CHEBI:37581
)
8-epiinuviscolide (
CHEBI:69344
)
is a
organic heterotricyclic compound (
CHEBI:26979
)
8-epiinuviscolide (
CHEBI:69344
)
is a
sesquiterpene lactone (
CHEBI:37667
)
8-epiinuviscolide (
CHEBI:69344
)
is a
tertiary alcohol (
CHEBI:26878
)
IUPAC Name
(3a
R
,4a
R
,5
R
,7a
S
,9a
R
)-
5-
hydroxy-
5-
methyl-
3,8-
dimethylidenedecahydroazuleno[6,5-
b
]furan-
2(3
H
)-
one
Registry Number
Type
Source
6769191
Reaxys Registry Number
Reaxys
Citation
Type
Source
21894898
PubMed citation
Europe PMC
Last Modified
09 January 2014