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Chemical structure of Gentisuric Acid

GD13954

Gentisuric Acid

Also known as 2-[(2,5-dihydroxybenzoyl)amino]acetic acid

Gentisuric acid has the molecular formula C₉H₉NO₅, a molecular weight of 211·17, and its chemical name is N-(2,5-dihydroxybenzoyl) glycine · Gentisuric acid is a metabolite of salicylic acid or aspirin and serves as a substrate for α-amidomonooxygenase (PAM), Gentisuric acid has the ability to alleviate DNA damage induced by mitomycin C

ChemicalCAS25351-24-0MW211.17FormulaC9H9NO5
CAS number
25351-24-0
Molecular weight
211.17
Formula
C9H9NO5
InChIKey
FBFATOOJCPDQOZ-UHFFFAOYSA-N
Catalogue number
GD13954
Brand
GLPBIO
Computed properties PubChem CID 161488 · XLogP 0.6 · TPSA 107 Ų · H-bond donors 4
XLogP
0.6
TPSA
107 Ų
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
15

SMILES C1=CC(=C(C=C1O)C(=O)NCC(=O)O)O

Computed descriptors from PubChem (CID 161488), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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