CHEBI:176763 - 4-Hydroxy-7-methoxy-1,3-benzodioxole-5-carboxylic acid

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ChEBI Name 4-Hydroxy-7-methoxy-1,3-benzodioxole-5-carboxylic acid
ChEBI ID CHEBI:176763
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C9H8O6
Net Charge 0
Average Mass 212.157
Monoisotopic Mass 212.03209
InChI InChI=1S/C9H8O6/c1-13-5-2-4(9(11)12)6(10)8-7(5)14-3-15-8/h2,10H,3H2,1H3,(H,11,12)
InChIKey CYZVRAUHGNBXIO-UHFFFAOYSA-N
SMILES O1C=2C(OC1)=C(O)C(=CC2OC)C(O)=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000118). See: MetaboLights Study
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000118). See: MetaboLights Study
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 4-Hydroxy-7-methoxy-1,3-benzodioxole-5-carboxylic acid (CHEBI:176763) is a methoxybenzoic acid (CHEBI:25238)
IUPAC Name
4-hydroxy-7-methoxy-1,3-benzodioxole-5-carboxylic acid
Manual Xrefs Databases
3230374 ChemSpider
HMDB0137303 HMDB
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