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CHEBI:134359 - 8-geranylesculetin
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ChEBI Name
8-geranylesculetin
ChEBI ID
CHEBI:134359
Definition
A member of the class of hydroxycoumarins that is esculetin in which the ring hydrogen at position 8 has been replaced by a geranyl group.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Kristian Axelsen
Supplier Information
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Formula
C19H22O4
Net Charge
0
Average Mass
314.376
Monoisotopic Mass
314.15181
InChI
InChI=1S/C19H22O4/c1-
12(2)
5-
4-
6-
13(3)
7-
9-
15-
18(22)
16(20)
11-
14-
8-
10-
17(21)
23-
19(14)
15/h5,7-
8,10-
11,20,22H,4,6,9H2,1-
3H3/b13-
7+
InChIKey
UFGRMMQWQBIHJB-NTUHNPAUSA-N
SMILES
C1(C/C=C(/CCC=C(C)C)\C)=C2C(=CC(=C1O)O)C=CC(O2)=O
ChEBI Ontology
Outgoing
8-geranylesculetin (
CHEBI:134359
)
has functional parent
esculetin (
CHEBI:490095
)
8-geranylesculetin (
CHEBI:134359
)
is a
hydroxycoumarin (
CHEBI:37912
)
8-geranylesculetin (
CHEBI:134359
)
is a
monoterpenoid (
CHEBI:25409
)
IUPAC Name
8-[(2
E
)-3,7-dimethylocta-2,6-dien-1-yl]-6,7-dihydroxy-2
H
-1-benzopyran-2-one
Synonyms
Sources
8-geranyl-6,7-dihydroxycoumarin
ChEBI
8-geranylesculetin
UniProt
Manual Xref
Database
C21496
KEGG COMPOUND
View more database links
Citation
Type
Source
25077796
PubMed citation
SUBMITTER
Last Modified
19 April 2017