2-Amino-3,4-dihydroxybenzoic acid; 4-Me ether, Me ester

AlkaPlorer ID: AK073796

Synonym: Methyl 2-amino-3-hydroxy-4-methoxybenzoate

IUPAC Name: methyl 2-amino-3-hydroxy-4-methoxybenzoate

Structure

SMILES: COC(=O)C1=C(N)C(O)=C(OC)C=C1

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InChI: InChI=1S/C9H11NO4/c1-13-6-4-3-5(9(12)14-2)7(10)8(6)11/h3-4,11H,10H2,1-2H3

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InChIKey: QBGAIEVOBDWSRU-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 197.19

TPSA: 81.78

MolLogP: 0.7696000000000001

Number of H-Donors: 2

Number of H-Acceptors: 5

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Bacillus subtilis Bacillus subtilis Activity nan None 10.1021/np800827w
Candida albicans Candida albicans Activity nan None 10.1021/np800827w
Escherichia coli Escherichia coli IZ nan None 10.1021/np800827w
Pseudomonas aeruginosa Pseudomonas aeruginosa IZ nan None 10.1021/np800827w
Rhizomucor miehei Rhizomucor miehei Activity nan None 10.1021/np800827w
Staphylococcus aureus Staphylococcus aureus IZ 11.0 mm 10.1021/np800827w

Metabolism Information