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3,4,5-trihydroxybenzoate

Properties

Image

Occurences in reactions

MNX_ID

MNXM670

	#reac
in my sandbox	0
in MNXref (generic)	19
in models (compartimentalized)	7

formula

C₇H₅O₅

charge

-1

mass

169.01425

reference

InChIKey

LNTHITQWFMADLM-UHFFFAOYSA-M

InChI

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

SMILES

O=C([O-])c1cc(O)c(O)c(O)c1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:16918 chebi:16918	3,4,5-trihydroxybenzoate gallate
envipath:...86304bed05ad envipathM:...86304bed05ad	Gallate
seed.compound:cpd01020 seedM:cpd01020	Gallate 3,4,5-Trihydroxybenzoate 3,4,5-Trihydroxybenzoic acid 3,4,5-trihydroxybenzoate 3,4,5-trihydroxybenzoic acid Gallic acid Pyrogallol-5-carboxylic acid ga gallate gallic acid pyrogallol-5-carboxylate pyrogallol-5-carboxylic acid
sabiork.compound:5573 sabiorkM:5573 kegg.compound:C01424 keggC:C01424	Gallate 3,4,5-Trihydroxybenzoate 3,4,5-Trihydroxybenzoic acid Gallic acid Pyrogallol-5-carboxylic acid
bigg.metabolite:ga biggM:ga	Gallic acid
hmdb:HMDB0005807	Gallic acid 3,4,5-Trihydroxy-benzoate 3,4,5-Trihydroxy-benzoic acid 3,4,5-Trihydroxybenzoate 3,4,5-Trihydroxybenzoic acid 3,4,5-Trihydroxybenzoic acid (acd/name 4.0) 3,4,5-trihydroxybenzoic acid Acid, gallic Gallate Gallic acid polymer Gallic acid tech. Galop Pyrogallol-5-carboxylate Pyrogallol-5-carboxylic acid galop
envipath:...12d2245b9ded envipathM:...12d2245b9ded	compound 0046975
metacyc.compound:CPD-183 metacycM:CPD-183	gallate 3,4,5-trihydroxybenzoate 3,4,5-trihydroxybenzoic acid gallic acid pyrogallol-5-carboxylate pyrogallol-5-carboxylic acid
CHEBI:30778 chebi:30778	gallic acid 3,4,5-Trihydroxybenzoic acid 3,4,5-trihydroxybenzoic acid Gallic acid Pyrogallol-5-carboxylic acid
hmdb:HMDB05807 chebi:11686 chebi:14291 chebi:24178 chebi:24180 chebi:5268 biggM:M_ga keggC:M_C01424 seedM:M_cpd01020	secondary/obsolete/fantasy identifier