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2-Amino-3-hydroxybenzoic acid; Me ether

AlkaPlorer ID: AK029562

Synonym: 2-Amino-3-methoxybenzoic acid, 3-Methoxyanthranilic acid

IUPAC Name: 2-amino-3-methoxybenzoate

Structure

SMILES: COC1=CC=CC(C(=O)[O-])=C1N

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InChI: InChI=1S/C8H9NO3/c1-12-6-4-2-3-5(7(6)9)8(10)11/h2-4H,9H2,1H3,(H,10,11)/p-1

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InChIKey: SXOPCLUOUFQBJV-UHFFFAOYSA-M

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Reference

PubChem CID: 9548666

SuperNatural Ⅲ: SN0358013

NPASS: NPC326293

COCONUT: CNP0141530

Source

Species Genus Family Order Class Phylum Kingdom Domain
Rattus norvegicus Rattus Muridae Rodentia Mammalia Chordata Metazoa Eukaryota

Properties Information

Molecule Weight: 166.15599999999998

TPSA？: 75.38

MolLogP？: -0.3591000000000001

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT014697 C[SAH].Nc1c(O)cccc1C(=O)O>>COc1cccc(C(=O)O)c1N R02671