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ChEBI
> Main
CHEBI:133689 - catechol β-
D
-glucuronide
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ChEBI Name
catechol β-
D
-glucuronide
ChEBI ID
CHEBI:133689
ChEBI ASCII Name
catechol beta-D-glucuronide
Definition
A glucosiduronic acid that is β-
D
-glucuronic acid in which the anomeric hydroxyl hydrogen has been replaced by a 2-hydroxyphenyl group.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C12H14O8
Net Charge
0
Average Mass
286.235
Monoisotopic Mass
286.06887
InChI
InChI=1S/C12H14O8/c13-
5-
3-
1-
2-
4-
6(5)
19-
12-
9(16)
7(14)
8(15)
10(20-
12)
11(17)
18/h1-
4,7-
10,12-
16H,(H,17,18)
/t7-
,8-
,9+,10-
,12+/m0/s1
InChIKey
ICPYZFZFSLTYID-GOVZDWNOSA-N
SMILES
C=1C=CC=C(C1O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(O)=O)O)O)O
Metabolite of Species
Details
Mus musculus
(NCBI:txid10090)
See:
PubMed
Roles Classification
Biological Role
(s):
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (
Mus musculus
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
catechol β-
D
-glucuronide (
CHEBI:133689
)
has functional parent
catechol (
CHEBI:18135
)
catechol β-
D
-glucuronide (
CHEBI:133689
)
has role
mouse metabolite (
CHEBI:75771
)
catechol β-
D
-glucuronide (
CHEBI:133689
)
is a
glucosiduronic acid (
CHEBI:24302
)
catechol β-
D
-glucuronide (
CHEBI:133689
)
is a
phenols (
CHEBI:33853
)
catechol β-
D
-glucuronide (
CHEBI:133689
)
is conjugate acid of
catechol β-
D
-glucuronide(1−) (
CHEBI:133691
)
Incoming
catechol β-
D
-glucuronide(1−) (
CHEBI:133691
)
is conjugate base of
catechol β-
D
-glucuronide (
CHEBI:133689
)
IUPAC Name
2-hydroxyphenyl β-
D
-glucopyranosiduronic acid
Synonyms
Sources
2-hydroxyphenyl β-
D
-glucosiduronic acid
ChEBI
2-hydroxyphenyl β-
D
-glucuronide
ChEBI
2-Hydroxyphenyl-beta-D-glucopyranosiduronic acid
ChemIDplus
catechol β-glucuronide
ChEBI
catechol glucuronide
ChEBI
Diphenol glucuronide
HMDB
Manual Xref
Database
HMDB0059998
HMDB
View more database links
Registry Numbers
Types
Sources
28151899
Reaxys Registry Number
Reaxys
28623-57-6
CAS Registry Number
ChemIDplus
Citation
Type
Source
1687010
PubMed citation
Europe PMC
Last Modified
07 October 2016