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> Main
CHEBI:847 - 2'-
O
-methylodoratol
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ChEBI Name
2'-
O
-methylodoratol
ChEBI ID
CHEBI:847
ChEBI ASCII Name
2'-O-methylodoratol
Definition
A member of the class of dihydrochalcones that is the 2'-
O
-methyl derivative of odoratol.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C18H20O5
Net Charge
0
Average Mass
316.34840
Monoisotopic Mass
316.13107
InChI
InChI=1S/C18H20O5/c1-
21-
13-
6-
4-
12(5-
7-
13)
10-
16(19)
18(20)
15-
9-
8-
14(22-
2)
11-
17(15)
23-
3/h4-
9,11,16,19H,10H2,1-
3H3
InChIKey
PQWHNGRYDDJGPN-UHFFFAOYSA-N
SMILES
COc1ccc(CC(O)C(=O)c2ccc(OC)cc2OC)cc1
Metabolite of Species
Details
Lathyrus odoratus
(NCBI:txid3859)
See:
DOI
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
2'-
O
-methylodoratol (
CHEBI:847
)
has functional parent
odoratol (
CHEBI:7729
)
2'-
O
-methylodoratol (
CHEBI:847
)
has role
plant metabolite (
CHEBI:76924
)
2'-
O
-methylodoratol (
CHEBI:847
)
is a
dihydrochalcones (
CHEBI:71230
)
2'-
O
-methylodoratol (
CHEBI:847
)
is a
dimethoxybenzene (
CHEBI:51681
)
2'-
O
-methylodoratol (
CHEBI:847
)
is a
secondary α-hydroxy ketone (
CHEBI:2468
)
2'-
O
-methylodoratol (
CHEBI:847
)
is a
secondary alcohol (
CHEBI:35681
)
IUPAC Name
1-(2,4-dimethoxyphenyl)-2-hydroxy-3-(4-methoxyphenyl)propan-1-one
Synonyms
Sources
Methylodoratol
KEGG COMPOUND
O-Methylodoratol
LIPID MAPS
Manual Xrefs
Databases
C00000981
KNApSAcK
C09774
KEGG COMPOUND
LMPK12120573
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
5087847
Reaxys Registry Number
Reaxys
94943-13-2
CAS Registry Number
KEGG COMPOUND
Last Modified
06 February 2018