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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:89493 - 2,6-Dimethoxybenzoic acid
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ChEBI Ontology
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ChEBI Name
2,6-Dimethoxybenzoic acid
ChEBI ID
CHEBI:89493
Stars
This entity has been manually annotated by a third party.
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Formula
C9H10O4
Net Charge
0
Average Mass
182.174
Monoisotopic Mass
182.05791
InChI
InChI=1S/C9H10O4/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3,(H,10,11)
InChIKey
MBIZFBDREVRUHY-UHFFFAOYSA-N
SMILES
O=C(O)C1=C(OC)C=CC=C1OC
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
Found in urine
(BTO:0001419)
. See:
PubMed
Homo sapiens
(NCBI:txid9606)
Found in blood
(UBERON:0000178)
. See:
PubMed
ChEBI Ontology
Outgoing
2,6-Dimethoxybenzoic acid (
CHEBI:89493
)
is a
benzenes (
CHEBI:22712
)
2,6-Dimethoxybenzoic acid (
CHEBI:89493
)
is a
carbonyl compound (
CHEBI:36586
)
Synonyms
Sources
2,6-Dimethoxy-Benzoic acid
HMDB
2,6-Dimethoxy-benzoic acid
HMDB
2,6-dimethoxybenzoic acid
HMDB
Manual Xrefs
Databases
C00040794
KNApSAcK
HMDB0029273
HMDB
View more database links
Citations
Types
Sources
19812218
PubMed citation
Europe PMC
20428313
PubMed citation
Europe PMC