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3-methylcatechol

PropertiesImage
MNX_IDMNXM1064 Image of MNXM1064
referencechebi:18404
formulaC7H8O2
global charge0
mol weight124.139
InChIKeyPGSWEKYNAOWQDF-UHFFFAOYSA-N
InChIInChI=1S/C7H8O2/c1-5-3-2-4-6(8)7(5)9/h2-4,8-9H,1H3
SMILESCC1=CC=CC(O)=C1O
MNX internals
InChI (mnx)InChI=1/C7H8O2/c1-5-3-2-4-6(8)7(5)9/h2-4,8-9H,1H3 Image of MNXM1064
SMILES (mnx)[CH3:1][C:5]1=[C:7]([OH:9])[C:6]([OH:8])=[CH:4][CH:2]=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)19
in models (compartimentalized) 3
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:18404
chebi:18404
PGSWEKYNAOWQDF-UHFFFAOYSA-N
3-methylcatechol
2,3-Dihydroxytoluene
2,3-dihydroxytoluene
3-METHYLCATECHOL
3-Methylcatechol
3-methylbenzene-1,2-diol

sabiork.compound:2587
sabiorkM:2587
kegg.compound:C02923
keggC:C02923
PGSWEKYNAOWQDF-UHFFFAOYSA-N
2,3-Dihydroxytoluene
3-Methylcatechol

bigg.metabolite:3mcat
biggM:3mcat
envipath:...555064a8f8f4
envipathM:...555064a8f8f4
vmhM:3mcat
vmhmetabolite:3mcat
PGSWEKYNAOWQDF-UHFFFAOYSA-N
3-Methylcatechol
hmdb:HMDB0301753
PGSWEKYNAOWQDF-UHFFFAOYSA-N
3-Methylcatechol
2,3-Dihydroxytoluene
2,3-Toluenediol
3-methylbenzene-1,2-diol
3-methylcatechol

seed.compound:cpd01871
seedM:cpd01871
PGSWEKYNAOWQDF-UHFFFAOYSA-N
3-Methylcatechol
2,3-Dihydroxytoluene
2,3-dihydroxytoluene
3-methylcatechol
3mcat

metacyc.compound:CPD-111
metacycM:CPD-111
PGSWEKYNAOWQDF-UHFFFAOYSA-N
3-methylcatechol
2,3-dihydroxytoluene

envipath:...d01703279465
envipathM:...d01703279465
envipath:...85588caf482a
envipathM:...85588caf482a
envipath:...b9533813b5e8
envipathM:...b9533813b5e8
envipath:...4b790fb57594
envipathM:...4b790fb57594
PGSWEKYNAOWQDF-UHFFFAOYSA-N
compound 0044250

envipath:...65d095831986
envipathM:...65d095831986
PGSWEKYNAOWQDF-UHFFFAOYSA-N
compound 0044251

chebi:11857
chebi:20127
chebi:43829
chebi:887
biggM:M_3mcat
keggC:M_C02923
seedM:M_cpd01871
vmhM:M_3mcat
secondary/obsolete/fantasy identifier