CHEBI:204548 - ethyl divaricatinate

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ChEBI Name ethyl divaricatinate
ChEBI ID CHEBI:204548
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H18O4
Net Charge 0
Average Mass 238.283
Monoisotopic Mass 238.12051
InChI InChI=1S/C13H18O4/c1-4-6-9-7-10(16-3)8-11(14)12(9)13(15)17-5-2/h7-8,14H,4-6H2,1-3H3
InChIKey ZTEGMSJYDACIAV-UHFFFAOYSA-N
SMILES O=C(OCC)C1=C(O)C=C(OC)C=C1CCC
Metabolite of Species Details
Protousnea (NCBI:txid235511) See: DOI
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 ethyl divaricatinate (CHEBI:204548) is a methoxybenzoic acid (CHEBI:25238)
IUPAC Name
ethyl 2-hydroxy-4-methoxy-6-propylbenzoate
Manual Xref Database
156348 ChemSpider
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