MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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1,2,3-trihydroxybenzene

	Properties	Image
MNX_ID	MNXM1775
reference	chebi:16164
formula	C₆H₆O₃
global charge	0
mol weight	126.111
InChIKey	WQGWDDDVZFFDIG-UHFFFAOYSA-N
InChI	InChI=1S/C6H6O3/c7-4-2-1-3-5(8)6(4)9/h1-3,7-9H
SMILES	OC1=CC=CC(O)=C1O

MNX internals

InChI (mnx)	InChI=1/C6H6O3/c7-4-2-1-3-5(8)6(4)9/h1-3,7-9H
SMILES (mnx)	[CH:1]1=[CH:2][C:4]([OH:7])=[C:6]([OH:9])[C:5]([OH:8])=[CH:3]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	16
in models (compartimentalized)	1

Similar chemical compounds in external resources
Identifier	Description
CHEBI:16164 chebi:16164 WQGWDDDVZFFDIG-UHFFFAOYSA-N	1,2,3-trihydroxybenzene 1,2,3-Benzenetriol 1,2,3-Trihydroxybenzene Pyrogallic acid Pyrogallol benzene-1,2,3-triol pyrogallol
hmdb:HMDB0013674 WQGWDDDVZFFDIG-UHFFFAOYSA-N	1,2,3-Trihydroxybenzene 1,2,3-Benzenetriol 1,2,3-Benzenetriol (acd/name 4.0) 1,2,3-Trihydroxy-benzene 1,2,3-Trihydroxybenzen 2,3-Dihydroxyphenol Acid, pyrogallic Benzene-1,2,3-triol C.I. oxidation base 32 Fouramine base ap Fouramine brown ap Fourrine 85 Fourrine PG Phenol Piral Pyro Pyrogallate Pyrogallic acid Pyrogallol benzene-1,2,3-triol pyrogallol
sabiork.compound:5390 sabiorkM:5390 kegg.compound:C01108 keggC:C01108 WQGWDDDVZFFDIG-UHFFFAOYSA-N	1,2,3-Trihydroxybenzene 1,2,3-Benzenetriol Pyrogallic acid Pyrogallol
envipath:...c59c656585f7 envipathM:...c59c656585f7 WQGWDDDVZFFDIG-UHFFFAOYSA-N	Pyrogallol
seed.compound:cpd00813 seedM:cpd00813 WQGWDDDVZFFDIG-UHFFFAOYSA-N	Pyrogallol 1,2,3-Benzenetriol 1,2,3-Trihydroxybenzene 1,2,3-benzenetriol 1,2,3-trihydroxybenzene C.I. 76515 C.I. Oxidation Base 32 Fouramine Brown AP PYRO Piral Pyro Pyrogallic acid benzene-1,2-3-triol fouramine base ap fourrine 85 fourrine PG pyrodal pyrogallic acid pyrogallol
envipath:...b1980876d90a envipathM:...b1980876d90a WQGWDDDVZFFDIG-UHFFFAOYSA-N	compound 0039029
metacyc.compound:PYROGALLOL metacycM:PYROGALLOL WQGWDDDVZFFDIG-UHFFFAOYSA-N	pyrogallol 1,2,3-benzenetriol 1,2,3-trihydroxybenzene C.I. 76515 C.I. oxidation base 32 benzene-1,2-3-triol fouramine base ap fouramine brown AP fourrine 85 fourrine PG piral pyro pyrogallic acid
hmdb:HMDB13674 chebi:11135 chebi:14985 chebi:22708 chebi:45264 chebi:482 keggC:M_C01108 seedM:M_cpd00813	secondary/obsolete/fantasy identifier