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ChEBI
> Main
CHEBI:9199 - sophoranone
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ChEBI Name
sophoranone
ChEBI ID
CHEBI:9199
Definition
A dihydroxyflavanone that is (2
S
)-flavanone substituted by hydroxy groups at positions 7 and 4' and prenyl groups at positions 3' and 5' respectively.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C30H36O4
Net Charge
0
Average Mass
460.60440
Monoisotopic Mass
460.26136
InChI
InChI=1S/C30H36O4/c1-
18(2)
7-
10-
21-
15-
23(16-
22(29(21)
33)
11-
8-
19(3)
4)
28-
17-
27(32)
25-
13-
14-
26(31)
24(30(25)
34-
28)
12-
9-
20(5)
6/h7-
9,13-
16,28,31,33H,10-
12,17H2,1-
6H3/t28-
/m0/s1
InChIKey
IORSRBKNYXPSDO-NDEPHWFRSA-N
SMILES
CC(C)=CCc1cc(cc(CC=C(C)C)c1O)[C@@H]1CC(=O)c2ccc(O)c(CC=C(C)C)c2O1
Metabolite of Species
Details
Sophora tonkinensis
(NCBI:txid714503)
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
sophoranone (
CHEBI:9199
)
has functional parent
(2
S
)-flavanone (
CHEBI:15606
)
sophoranone (
CHEBI:9199
)
has role
plant metabolite (
CHEBI:76924
)
sophoranone (
CHEBI:9199
)
is a
4'-hydroxyflavanones (
CHEBI:140331
)
sophoranone (
CHEBI:9199
)
is a
dihydroxyflavanone (
CHEBI:38749
)
Synonym
Source
(2
S
)-
7-
hydroxy-
2-
[4-
hydroxy-
3,5-
bis(3-
methylbut-
2-
en-
1-
yl)phenyl]-
8-
(3-
methylbut-
2-
en-
1-
yl)-
2,3-
dihydro-
4
H
-
1-
benzopyran-
4-
one
ChEBI
Manual Xrefs
Databases
C00001005
KNApSAcK
C08719
KEGG COMPOUND
LMPK12140034
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
1332986
Reaxys Registry Number
Reaxys
23057-55-8
CAS Registry Number
KEGG COMPOUND
Citations
Types
Sources
12115492
PubMed citation
Europe PMC
24345512
PubMed citation
Europe PMC
26068519
PubMed citation
Europe PMC
Last Modified
05 April 2018