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:134358 - 8-geranylumbelliferone
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
8-geranylumbelliferone
ChEBI ID
CHEBI:134358
Definition
A member of the class of hydroxycoumarins that is umbelliferone in which the ring hydrogen at position 8 has been replaced by a geranyl group.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
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C19H22O3
Net Charge
0
Average Mass
298.377
Monoisotopic Mass
298.15689
InChI
InChI=1S/C19H22O3/c1-
13(2)
5-
4-
6-
14(3)
7-
10-
16-
17(20)
11-
8-
15-
9-
12-
18(21)
22-
19(15)
16/h5,7-
9,11-
12,20H,4,6,10H2,1-
3H3/b14-
7+
InChIKey
QPMKRRUDQIKGNH-VGOFMYFVSA-N
SMILES
C1(C/C=C(/CCC=C(C)C)\C)=C2C(=CC=C1O)C=CC(O2)=O
Metabolite of Species
Details
Luvunga sarmentosa
(IPNI:774221-1)
Found in leaf
(BTO:0000713)
. See:
PubMed
Paramignya trimera
(NCBI:txid1553915)
Found in stem
(BTO:0001300)
. 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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
8-geranylumbelliferone (
CHEBI:134358
)
has functional parent
umbelliferone (
CHEBI:27510
)
8-geranylumbelliferone (
CHEBI:134358
)
has role
plant metabolite (
CHEBI:76924
)
8-geranylumbelliferone (
CHEBI:134358
)
is a
hydroxycoumarin (
CHEBI:37912
)
8-geranylumbelliferone (
CHEBI:134358
)
is a
monoterpenoid (
CHEBI:25409
)
IUPAC Name
8-[(2
E
)-3,7-dimethylocta-2,6-dien-1-yl]-7-hydroxy-2
H
-1-benzopyran-2-one
Synonyms
Sources
8-Geranyl-7-hydroxycoumarin
KNApSAcK
8-geranylumbelliferone
UniProt
Manual Xrefs
Databases
C00019878
KNApSAcK
C21495
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
23660-05-1
CAS Registry Number
KNApSAcK
6959110
Reaxys Registry Number
Reaxys
Citations
Types
Sources
12127593
PubMed citation
Europe PMC
25077796
PubMed citation
SUBMITTER
28245363
PubMed citation
Europe PMC
Last Modified
19 April 2017