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CHEBI:81409 - irigenin
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ChEBI Name
irigenin
ChEBI ID
CHEBI:81409
Definition
A hydroxyisoflavone that is isoflavone substituted by hydroxy groups at positions 5, 7 and 3' and methoxy groups at positions 6, 4' and 5' respectively.
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This entity has been manually annotated by the ChEBI Team.
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Read full article at Wikipedia
Formula
C18H16O8
Net Charge
0
Average Mass
360.31480
Monoisotopic Mass
360.08452
InChI
InChI=1S/C18H16O8/c1-
23-
13-
5-
8(4-
10(19)
17(13)
24-
2)
9-
7-
26-
12-
6-
11(20)
18(25-
3)
16(22)
14(12)
15(9)
21/h4-
7,19-
20,22H,1-
3H3
InChIKey
TUGWPJJTQNLKCL-UHFFFAOYSA-N
SMILES
COc1cc(cc(O)c1OC)-c1coc2cc(O)c(OC)c(O)c2c1=O
Metabolite of Species
Details
Iris germanica
(NCBI:txid34205)
Found in rhizome
(BTO:0001181)
. See:
PubMed
Iris domestica
(NCBI:txid58944)
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
irigenin (
CHEBI:81409
)
has functional parent
isoflavone (
CHEBI:18220
)
irigenin (
CHEBI:81409
)
has role
plant metabolite (
CHEBI:76924
)
irigenin (
CHEBI:81409
)
is a
4'-methoxyisoflavones (
CHEBI:133959
)
irigenin (
CHEBI:81409
)
is a
hydroxyisoflavone (
CHEBI:38755
)
Incoming
iridin (
CHEBI:5963
)
has functional parent
irigenin (
CHEBI:81409
)
Synonym
Source
5,7,3'-trihydroxy-6,4',5'-trimethoxyisoflavone
ChEBI
Manual Xrefs
Databases
C17957
KEGG COMPOUND
Irigenin
Wikipedia
LMPK12050417
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
345805
Reaxys Registry Number
Reaxys
548-76-5
CAS Registry Number
KEGG COMPOUND
548-76-5
CAS Registry Number
ChemIDplus
Citations
Types
Sources
22071270
PubMed citation
Europe PMC
25036154
PubMed citation
Europe PMC
25204177
PubMed citation
Europe PMC
Last Modified
17 November 2016