CHEBI:37276 - (1-hydroxycyclohexyl)acetic acid

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ChEBI Name (1-hydroxycyclohexyl)acetic acid
ChEBI ID CHEBI:37276
Definition A 3-hydroxy monocarboxylic acid consisting of cyclohexane carrying carboxymethyl and hydroxy substituents both at the 1-position.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C8H14O3
Net Charge 0
Average Mass 158.19496
Monoisotopic Mass 158.09429
InChI InChI=1S/C8H14O3/c9-7(10)6-8(11)4-2-1-3-5-8/h11H,1-6H2,(H,9,10)
InChIKey AADJJWDBCQRALD-UHFFFAOYSA-N
SMILES OC(=O)CC1(O)CCCCC1
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 (1-hydroxycyclohexyl)acetic acid (CHEBI:37276) has functional parent acetic acid (CHEBI:15366)
(1-hydroxycyclohexyl)acetic acid (CHEBI:37276) is a 3-hydroxy monocarboxylic acid (CHEBI:35969)
Incoming (1-hydroxycyclohexyl)acetyl-CoA (CHEBI:15448) has functional parent (1-hydroxycyclohexyl)acetic acid (CHEBI:37276)
Synonym Source
1-hydroxycyclohexaneacetic acid ChEBI
Registry Numbers Types Sources
2207501 Reaxys Registry Number Reaxys
2207501 Beilstein Registry Number Beilstein
Last Modified
14 March 2011