CHEBI:167756 - 3-tert-butyladipic acid

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ChEBI Name 3-tert-butyladipic acid
ChEBI ID CHEBI:167756
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H18O4
Net Charge 0
Average Mass 202.250
Monoisotopic Mass 202.12051
InChI InChI=1S/C10H18O4/c1-10(2,3)7(6-9(13)14)4-5-8(11)12/h7H,4-6H2,1-3H3,(H,11,12)(H,13,14)
InChIKey LHSCNQRBIIDZCB-UHFFFAOYSA-N
SMILES OC(=O)CC(C(C)(C)C)CCC(O)=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood serum (BTO:0000133). 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 3-tert-butyladipic acid (CHEBI:167756) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name
3-tert-butylhexanedioic acid
Manual Xref Database
89392 ChemSpider
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Registry Number Type Source
10347-88-3 CAS Registry Number ChemIDplus