Molecule

2-Aminobenzoic acid; Amide

AlkaPlorer ID: AK016049

Synonym: 2-Aminobenzamide, Anthranilamide

IUPAC Name: 2-aminobenzamide

Structure

SMILES: N=C(O)C1=CC=CC=C1N

InChI: InChI=1S/C7H8N2O/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,8H2,(H2,9,10)

InChIKey: PXBFMLJZNCDSMP-UHFFFAOYSA-N

Reference

Pyramidamycins A-D and 3-hydroxyquinoline-2-carboxamide; cytotoxic benzamides from Streptomyces sp. DGC1

PubChem CID: 6942

CAS: 1144035-53-9

LOTUS: LTS0276261

SuperNatural Ⅲ: SN0297433

COCONUT: CNP0187494

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Streptomyces sp.	Streptomyces	Streptomycetaceae	Kitasatosporales	Actinomycetes	Actinomycetota	None	Bacteria
None	Cytophaga	Cytophagaceae	Cytophagales	Cytophagia	Bacteroidota	None	Bacteria

Properties Information

Molecule Weight: 136.15399999999994

TPSA？: 70.1

MolLogP？: 1.15217

Number of H-Donors: 3

Number of H-Acceptors: 2

RingCount: 1

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Alternaria solani	Alternaria solani	Inhibition	42.3	%	10.1016/j.ejmech.2011.01.031
Aspergillus niger	Aspergillus niger	Activity	nan	None	10.1007/s00044-010-9537-5
Aspergillus niger	Aspergillus niger	-logMIC	1.64	None	10.1007/s00044-010-9537-5
Bacillus subtilis	Bacillus subtilis	Activity	nan	None	10.1007/s00044-010-9537-5
Bacillus subtilis	Bacillus subtilis	-logMIC	1.94	None	10.1007/s00044-010-9537-5
Candida albicans	Candida albicans	Activity	nan	None	10.1007/s00044-010-9537-5
Candida albicans	Candida albicans	-logMIC	1.04	None	10.1007/s00044-010-9537-5
Escherichia coli	Escherichia coli	Activity	nan	None	10.1007/s00044-010-9537-5
Escherichia coli	Escherichia coli	-logMIC	1.04	None	10.1007/s00044-010-9537-5
Fusarium	Fusarium	Inhibition	27.8	%	10.1016/j.ejmech.2011.01.031
Fusarium graminearum	Fusarium graminearum	Inhibition	38.0	%	10.1016/j.ejmech.2011.01.031
Homo sapiens	Chromobox protein homolog 1	Potency	56234.1	nM	None
Homo sapiens	DNA polymerase iota	Potency	100000.0	nM	None
Homo sapiens	Heat shock protein HSP 90-beta	IC50	4000000.0	nM	10.1021/jm900357y
Homo sapiens	Regulator of G-protein signaling 4	Potency	112201.8	nM	None
Mycosphaerella arachidis	Mycosphaerella arachidis	Inhibition	52.0	%	10.1016/j.ejmech.2011.01.031
Physalospora piricola	Physalospora piricola	Inhibition	43.2	%	10.1016/j.ejmech.2011.01.031
Rattus norvegicus	Thioredoxin reductase 1, cytoplasmic	Potency	79432.8	nM	None
Staphylococcus aureus	Staphylococcus aureus	Activity	nan	None	10.1007/s00044-010-9537-5
Staphylococcus aureus	Staphylococcus aureus	-logMIC	1.04	None	10.1007/s00044-010-9537-5
None	No relevant target	LogP	-2.72	None	10.1021/jm010289a
None	No relevant target	LogP	0.32	None	10.1021/jm010289a
None	Unchecked	Inhibition	1.0	%	10.1016/j.bmcl.2018.03.002

Metabolism Information

AKRT ID	Reaction	Reaction Link ID
AKRT015796	N#Cc1ccccc1N>>NC(=O)c1ccccc1N	retrobiocat_1096
AKRT017282	NC(=O)c1ccccc1N>>Nc1ccccc1C(=O)O	enzymemap_77372
AKRT020737	Nc1ccccc1C(=O)NO>>NC(=O)c1ccccc1N	enzymemap_24266