gallate

Chemical Formula:

C₇H₅O₅

Molecular Weight:

169.113 Daltons

Monoisotopic Mass:

170.0215233031 Daltons

SMILES:

C([O-])(=O)C1(C=C(C(=C(C=1)O)O)O)

InChI:

1S/C7H6O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,8-10H,(H,11,12)/p-1

InChIKey:

LNTHITQWFMADLM-UHFFFAOYSA-M

Synonyms

gallic acid
3,4,5-trihydroxybenzoic acid
3,4,5-trihydroxybenzoate
pyrogallol-5-carboxylic acid
pyrogallol-5-carboxylate

Databases

MetaCyc: CPD-183

RefMet: Gallic acid

HMDB: HMDB05807

ChemSpider: 3790309

PubChem (CID): 54675821 370

ChEBI: 16918 30778

KEGG: C01424 c01424

UMBBD-Compounds: c0006

CAS: 149-91-7

Seed: cpd01020

MetaNetX: MNXM670

PupChem (SID): 4609

CHEMBL: CHEMBL288114

KNApSAcK: C00002647

PDB-CCD: GDE

3DMET: B00289

NIKKAJI: J7.408J