4-Amino-3-hydroxybenzoic acid; N-Ac 

AlkaPlorer ID: AK011468

Synonym: None

IUPAC Name: 4-acetamido-3-hydroxybenzoic acid

Structure

SMILES: CC(O)=NC1=CC=C(C(=O)O)C=C1O

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InChI: InChI=1S/C9H9NO4/c1-5(11)10-7-3-2-6(9(13)14)4-8(7)12/h2-4,12H,1H3,(H,10,11)(H,13,14)

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InChIKey: WEMQDIKMQHBQIC-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 195.174

TPSA: 90.12

MolLogP: 1.6983

Number of H-Donors: 3

Number of H-Acceptors: 3

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens Lysine-specific demethylase 5A Inhibition nan % 10.1016/j.bmcl.2019.03.028
Homo sapiens Sialidase 3 Inhibition 33.0 % 10.1021/jm970479e
Influenza A virus Influenza A virus IC50 10000000.0 nM 10.1021/jm00017a005
Influenza B virus Influenza B virus IC50 10000000.0 nM 10.1021/jm00017a005

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT004735 CC(=O)[CoA].Nc1ccc(C(=O)O)cc1O>>CC(=O)Nc1ccc(C(=O)O)cc1O enzymemap_31204