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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:3162 - bowdichione
Main
ChEBI Ontology
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ChEBI Name
bowdichione
ChEBI ID
CHEBI:3162
Definition
A hydroxyisoflavone with a quinone structure in ring B. Isolated from
Dalbergia parviflora
, it exhibits antineoplastic and anti-inflammatory activities.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C16H10O6
Net Charge
0
Average Mass
298.24700
Monoisotopic Mass
298.04774
InChI
InChI=1S/C16H10O6/c1-21-15-6-12(18)10(5-13(15)19)11-7-22-14-4-8(17)2-3-9(14)16(11)20/h2-7,17H,1H3
InChIKey
GCAIEHBYLQNGAF-UHFFFAOYSA-N
SMILES
COC1=CC(=O)C(=CC1=O)c1coc2cc(O)ccc2c1=O
Roles Classification
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application
(s):
antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
anti-inflammatory agent
Any compound that has anti-inflammatory effects.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
bowdichione (
CHEBI:3162
)
has role
anti-inflammatory agent (
CHEBI:67079
)
bowdichione (
CHEBI:3162
)
has role
antineoplastic agent (
CHEBI:35610
)
bowdichione (
CHEBI:3162
)
has role
metabolite (
CHEBI:25212
)
bowdichione (
CHEBI:3162
)
is a
1,4-benzoquinones (
CHEBI:132124
)
bowdichione (
CHEBI:3162
)
is a
hydroxyisoflavone (
CHEBI:38755
)
bowdichione (
CHEBI:3162
)
is a
methoxyisoflavone (
CHEBI:38756
)
bowdichione (
CHEBI:3162
)
is a
oxoisoflavone (
CHEBI:50278
)
IUPAC Name
2-(7-hydroxy-4-oxo-4
H
-chromen-3-yl)-5-methoxybenzo-1,4-quinone
Synonym
Source
Bowdichione
KEGG COMPOUND
Manual Xrefs
Databases
C00002511
KNApSAcK
C10202
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
1656717
Beilstein Registry Number
Beilstein
1656717
Reaxys Registry Number
Reaxys
53774-75-7
CAS Registry Number
KEGG COMPOUND
Citations
Types
Sources
19928832
PubMed citation
Europe PMC
9525107
PubMed citation
Europe PMC
Last Modified
03 June 2016