2-Amino-4,5-dihydroxybenzoic acid

AlkaPlorer ID: AK268858

Synonym: 6-Aminoprotocatechuic acid, 4,5-Dihydroxyanthranilic acid

IUPAC Name: 2-amino-4,5-dihydroxybenzoic acid

Structure

SMILES: NC1=CC(O)=C(O)C=C1C(=O)O

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InChI: InChI=1S/C7H7NO4/c8-4-2-6(10)5(9)1-3(4)7(11)12/h1-2,9-10H,8H2,(H,11,12)

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InChIKey: XBLOQICXEUCEPK-UHFFFAOYSA-N

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Reference

PubChem CID: 10012309

CAS: 114874-99-6

SuperNatural Ⅲ: SN0425661

COCONUT: CNP0323910

Source

Species Genus Family Order Class Phylum Kingdom Domain
Botrytis sp. Botrytis Sclerotiniaceae Helotiales Leotiomycetes Ascomycota Fungi Eukaryota

Properties Information

Molecule Weight: 169.13599999999997

TPSA: 103.78000000000002

MolLogP: 0.3782

Number of H-Donors: 4

Number of H-Acceptors: 4

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information