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

**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

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2,5-dihydroxybenzaldehyde

	Properties	Image
MNX_ID	MNXM4270
reference	chebi:28508
formula	C₇H₆O₃
global charge	0
mol weight	138.122
InChIKey	CLFRCXCBWIQVRN-UHFFFAOYSA-N
InChI	InChI=1S/C7H6O3/c8-4-5-3-6(9)1-2-7(5)10/h1-4,9-10H
SMILES	O=Cc1cc(O)ccc1O

MNX internals

InChI (mnx)	InChI=1/C7H6O3/c8-4-5-3-6(9)1-2-7(5)10/h1-4,9-10H
SMILES (mnx)	[c:1]1([OH:9])[cH:2][cH:6][c:4]([CH3:7])[c:3]([O:10]=[O:8])[cH:5]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	3

Similar chemical compounds in external resources
Identifier	Description
CHEBI:28508 chebi:28508 CLFRCXCBWIQVRN-UHFFFAOYSA-N	2,5-dihydroxybenzaldehyde 2,5-Dihydroxybenzaldehyde Gentisate aldehyde gentisaldehyde
bigg.metabolite:HC01522 biggM:HC01522 CLFRCXCBWIQVRN-UHFFFAOYSA-N	Gentisate aldehyde
kegg.compound:C05585 keggC:C05585 CLFRCXCBWIQVRN-UHFFFAOYSA-N	Gentisate aldehyde 2,5-Dihydroxybenzaldehyde
hmdb:HMDB0004062 CLFRCXCBWIQVRN-UHFFFAOYSA-N	Gentisate aldehyde 2,5-Dihydroxybenzaldehyde 2,5-Dihydroxybenzaldehyde polymer 2,5-dihydroxybenzaldehyde Gentisaldehyde Gentisic acid aldehyde
seed.compound:cpd03315 seedM:cpd03315 CLFRCXCBWIQVRN-UHFFFAOYSA-N	Gentisate aldehyde 2,5-Dihydroxybenzaldehyde 2,5-dihydroxybenzaldehyde gentisaldehyde gentisate aldehyde
vmhM:HC01522 vmhM:HC01522 vmhmetabolite:HC01522 vmhmetabolite:HC01522 CLFRCXCBWIQVRN-UHFFFAOYSA-N	Gentisate aldehyde 2,5-dihydroxybenzaldehyde
envipath:...61be6cd218c0 envipathM:...61be6cd218c0 envipath:...775f7a0cd679 envipathM:...775f7a0cd679 envipath:...188d73a439d3 envipathM:...188d73a439d3 envipath:...25338ef67aa9 envipathM:...25338ef67aa9 CLFRCXCBWIQVRN-UHFFFAOYSA-N	compound 0053218
metacyc.compound:CPD-16722 metacycM:CPD-16722 CLFRCXCBWIQVRN-UHFFFAOYSA-N	gentisaldehyde 2,5-dihydroxybenzaldehyde gentisate aldehyde
hmdb:HMDB04062 chebi:24217 chebi:50203 chebi:5322 biggM:M_HC01522 keggC:M_C05585 seedM:M_cpd03315 vmhM:M_HC01522	secondary/obsolete/fantasy identifier