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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:8359 - pratensein
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ChEBI Name
pratensein
ChEBI ID
CHEBI:8359
Definition
A member of the class of 7-hydroxyisoflavones in which isoflavone is substituted by hydroxy groups at the 5, 7, and 3' positions, and by a methoxy group at the 4' position.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C16H12O6
Net Charge
0
Average Mass
300.26290
Monoisotopic Mass
300.06339
InChI
InChI=1S/C16H12O6/c1-21-13-3-2-8(4-11(13)18)10-7-22-14-6-9(17)5-12(19)15(14)16(10)20/h2-7,17-19H,1H3
InChIKey
FPIOBTBNRZPWJW-UHFFFAOYSA-N
SMILES
COc1ccc(cc1O)-c1coc2cc(O)cc(O)c2c1=O
ChEBI Ontology
Outgoing
pratensein (
CHEBI:8359
)
is a
4'-methoxyisoflavones (
CHEBI:133959
)
pratensein (
CHEBI:8359
)
is a
7-hydroxyisoflavones (
CHEBI:55465
)
pratensein (
CHEBI:8359
)
is conjugate acid of
pratensein(1−) (
CHEBI:61323
)
Incoming
pratensein(1−) (
CHEBI:61323
)
is conjugate base of
pratensein (
CHEBI:8359
)
IUPAC Name
5,7-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-4
H
-chromen-4-one
Synonyms
Sources
3',5,7-trihydroxy-4'-methoxyisoflavone
ChEBI
3'-hydroxy-biochanin A
ChEBI
3'-hydroxybiochanin A
ChEBI
5,7,3'-trihydroxy-4'-methoxyisoflavone
ChEBI
5,7-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-4
H
-1-benzopyran-4-one
ChemIDplus
Pratensein
KEGG COMPOUND
Manual Xrefs
Databases
C00002563
KNApSAcK
C10520
KEGG COMPOUND
CN101669936
Patent
CPD-3622
MetaCyc
EP1392239
Patent
HMDB0030617
HMDB
LMPK12050265
LIPID MAPS
Pratensein
Wikipedia
View more database links
Registry Numbers
Types
Sources
1293940
Reaxys Registry Number
Reaxys
2284-31-3
CAS Registry Number
KEGG COMPOUND
2284-31-3
CAS Registry Number
ChemIDplus
Citations
Types
Sources
19571401
PubMed citation
Europe PMC
19637114
PubMed citation
Europe PMC
22494026
PubMed citation
Europe PMC
23030687
PubMed citation
Europe PMC
Last Modified
17 November 2016