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CHEBI:133744 - homovanillate
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ChEBI Ontology
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ChEBI Name
homovanillate
ChEBI ID
CHEBI:133744
Definition
A hydroxy monocarboxylic acid anion which is obtained by deprotonation of the carboxy group of homovanillic acid.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C9H9O4
Net Charge
-1
Average Mass
181.166
Monoisotopic Mass
181.05063
InChI
InChI=1S/C9H10O4/c1-13-8-4-6(5-9(11)12)2-3-7(8)10/h2-4,10H,5H2,1H3,(H,11,12)/p-1
InChIKey
QRMZSPFSDQBLIX-UHFFFAOYSA-M
SMILES
C1=C(C(=CC(=C1)CC([O-])=O)OC)O
Roles Classification
Biological Role
(s):
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (
Mus musculus
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
homovanillate (
CHEBI:133744
)
has role
human metabolite (
CHEBI:77746
)
homovanillate (
CHEBI:133744
)
has role
mouse metabolite (
CHEBI:75771
)
homovanillate (
CHEBI:133744
)
is a
hydroxy monocarboxylic acid anion (
CHEBI:36059
)
homovanillate (
CHEBI:133744
)
is conjugate base of
homovanillic acid (
CHEBI:545959
)
Incoming
homovanillic acid (
CHEBI:545959
)
is conjugate acid of
homovanillate (
CHEBI:133744
)
IUPAC Name
(4-hydroxy-3-methoxyphenyl)acetate
Synonym
Source
3-methoxy-4-hydroxyphenylacetate
ChEBI
Last Modified
11 May 2017