CHEBI:167758 - 5-amino-3-(4-methoxyphenyl)-5-oxopentanoic acid

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 5-amino-3-(4-methoxyphenyl)-5-oxopentanoic acid
ChEBI ID CHEBI:167758
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H15NO4
Net Charge 0
Average Mass 237.255
Monoisotopic Mass 237.10011
InChI InChI=1S/C12H15NO4/c1-17-10-4-2-8(3-5-10)9(6-11(13)14)7-12(15)16/h2-5,9H,6-7H2,1H3,(H2,13,14)(H,15,16)
InChIKey TWOBZOCYRADJOC-UHFFFAOYSA-N
SMILES O(C1=CC=C(C(CC(=O)N)CC(O)=O)C=C1)C
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 5-amino-3-(4-methoxyphenyl)-5-oxopentanoic acid (CHEBI:167758) is a benzenes (CHEBI:22712)
5-amino-3-(4-methoxyphenyl)-5-oxopentanoic acid (CHEBI:167758) is a monocarboxylic acid (CHEBI:25384)
IUPAC Name
5-amino-3-(4-methoxyphenyl)-5-oxopentanoic acid
Manual Xref Database
2082317 ChemSpider
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