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

Feedback

veratrole

	Properties	Image
MNX_ID	MNXM88792
reference	chebi:59114
formula	C₈H₁₀O₂
global charge	0
mol weight	138.166
InChIKey	ABDKAPXRBAPSQN-UHFFFAOYSA-N
InChI	InChI=1S/C8H10O2/c1-9-7-5-3-4-6-8(7)10-2/h3-6H,1-2H3
SMILES	COC1=CC=CC=C1OC

MNX internals

InChI (mnx)	InChI=1/C8H10O2/c1-9-7-5-3-4-6-8(7)10-2/h3-6H,1-2H3
SMILES (mnx)	[CH3:1][O:9][C:7]1=[CH:5][CH:3]=[CH:4][CH:6]=[C:8]1[O:10][CH3:2]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:59114 chebi:59114 ABDKAPXRBAPSQN-UHFFFAOYSA-N	veratrole 1,2-dimethoxybenzene 2-Dimethoxybenzol 2-Methoxyanisole Catechol dimethyl ether Methyl guaiacol O,O-Dimethyl catechol Pyrocatechol dimethyl ether o-Dimethoxybenzene
hmdb:HMDB0032139 ABDKAPXRBAPSQN-UHFFFAOYSA-N	1,2-Dimethoxybenzene 1,2-dimethoxybenzene 2-Dimethoxybenzol 2-Methoxyanisole Catechol dimethyl ether FEMA 3799 Guaiacol methylether Methyl guaiacol O,O-Dimethyl catechol O-Dimethoxy-benzene O-Dimethoxybenzene Orthodimethoxybenzene Pyrocatechol dimethyl ether Synthol Veratrol Veratrole veratrole
sabiork.compound:21070 sabiorkM:21070 ABDKAPXRBAPSQN-UHFFFAOYSA-N	Veratrole
envipath:...b522ccd64090 envipathM:...b522ccd64090 ABDKAPXRBAPSQN-UHFFFAOYSA-N	compound 0287492
metacyc.compound:CPD-24802 metacycM:CPD-24802 ABDKAPXRBAPSQN-UHFFFAOYSA-N	veratrole 1,2-dimethoxybenzene 2-methoxyanisole O,O-dimethyl catechol methyl guaiacol pyrocatechol dimethyl ether
hmdb:HMDB32139	secondary/obsolete/fantasy identifier