CHEBI:105753 - 2-[2-bromo-4-(hydroxymethyl)-6-methoxyphenoxy]acetic acid

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ChEBI Name 2-[2-bromo-4-(hydroxymethyl)-6-methoxyphenoxy]acetic acid
ChEBI ID CHEBI:105753
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C10H11BrO5
Net Charge 0
Average Mass 291.095
Monoisotopic Mass 289.97899
InChI InChI=1S/C10H11BrO5/c1-15-8-3-6(4-12)2-7(11)10(8)16-5-9(13)14/h2-3,12H,4-5H2,1H3,(H,13,14)
InChIKey VJXXDNCSRIIQSG-UHFFFAOYSA-N
SMILES COC1=C(C(=CC(=C1)CO)Br)OCC(=O)O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 2-[2-bromo-4-(hydroxymethyl)-6-methoxyphenoxy]acetic acid (CHEBI:105753) is a monocarboxylic acid (CHEBI:25384)
Manual Xref Database
LSM-17115 LINCS
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