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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:15789 - 2'-
O
-methyllicodione
Main
ChEBI Ontology
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ChEBI Name
2'-
O
-methyllicodione
ChEBI ID
CHEBI:15789
ChEBI ASCII Name
2'-O-methyllicodione
Definition
A β-diketone that is licodione in which the hydroxy group at position 2 of the 2,4-dihyroxyphenyl moiety has been converted into the its methyl ether.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:846, CHEBI:11393, CHEBI:19230
Supplier Information
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Molfile
Formula
C16H14O5
Net Charge
0
Average Mass
286.27940
Monoisotopic Mass
286.08412
InChI
InChI=1S/C16H14O5/c1-21-16-8-12(18)6-7-13(16)15(20)9-14(19)10-2-4-11(17)5-3-10/h2-8,17-18H,9H2,1H3
InChIKey
DMOSJPZKOKLUKK-UHFFFAOYSA-N
SMILES
COc1cc(O)ccc1C(=O)CC(=O)c1ccc(O)cc1
ChEBI Ontology
Outgoing
2'-
O
-methyllicodione (
CHEBI:15789
)
has functional parent
licodione (
CHEBI:18131
)
2'-
O
-methyllicodione (
CHEBI:15789
)
is a
β-diketone (
CHEBI:67265
)
2'-
O
-methyllicodione (
CHEBI:15789
)
is a
aromatic ether (
CHEBI:35618
)
2'-
O
-methyllicodione (
CHEBI:15789
)
is a
aromatic ketone (
CHEBI:76224
)
2'-
O
-methyllicodione (
CHEBI:15789
)
is a
dihydrochalcones (
CHEBI:71230
)
2'-
O
-methyllicodione (
CHEBI:15789
)
is a
phenols (
CHEBI:33853
)
2'-
O
-methyllicodione (
CHEBI:15789
)
is conjugate acid of
2'-
O
-methyllicodione(1−) (
CHEBI:77642
)
Incoming
2'-
O
-methyllicodione(1−) (
CHEBI:77642
)
is conjugate base of
2'-
O
-methyllicodione (
CHEBI:15789
)
IUPAC Name
1-(4-hydroxy-2-methoxyphenyl)-3-(4-hydroxyphenyl)propane-1,3-dione
Synonym
Source
2'-O-Methyllicodione
KEGG COMPOUND
Manual Xrefs
Databases
C00006995
KNApSAcK
C02922
KEGG COMPOUND
CPD-4302
MetaCyc
LMPK12120397
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
3619661
Reaxys Registry Number
Reaxys
3619661
Beilstein Registry Number
Beilstein
Last Modified
28 April 2020