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

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4-methylbenzyl alcohol

	Properties	Image
MNX_ID	MNXM3500
reference	chebi:1895
formula	C₈H₁₀O
global charge	0
mol weight	122.167
InChIKey	KMTDMTZBNYGUNX-UHFFFAOYSA-N
InChI	InChI=1S/C8H10O/c1-7-2-4-8(6-9)5-3-7/h2-5,9H,6H2,1H3
SMILES	CC1=CC=C(CO)C=C1

MNX internals

InChI (mnx)	InChI=1/C8H10O/c1-7-2-4-8(6-9)5-3-7/h2-5,9H,6H2,1H3
SMILES (mnx)	[CH3:1][C:7]1=[CH:3][CH:5]=[C:8]([CH2:6][OH:9])[CH:4]=[CH:2]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	8
in models (compartimentalized)	2

Similar chemical compounds in external resources
Identifier	Description
CHEBI:1895 chebi:1895 KMTDMTZBNYGUNX-UHFFFAOYSA-N	4-methylbenzyl alcohol (4-methylphenyl)methanol 4-(hydroxymethyl)toluene 4-tolylcarbinol alpha-Hydroxy-p-xylene p-methylbenzyl alcohol p-tolyl alcohol p-tolylcarbinol
vmhM:4mboh vmhmetabolite:4mboh KMTDMTZBNYGUNX-UHFFFAOYSA-N	4-Methylbenzyl alcohol (4-methylphenyl)methanol
hmdb:HMDB0041609 KMTDMTZBNYGUNX-UHFFFAOYSA-N	4-Methylbenzyl alcohol (4-methylphenyl)methanol 1-Hydroxymethyl-4-methylbenzene 4-(Hydroxymethyl)toluene 4-Methylbenzenemethanol, 9ci 4-Tolylcarbinol 4-methylbenzyl alcohol P-Tolylmethanol a-Hydroxy-p-xylene alpha-Hydroxy-p-xylene alpha-hydroxy-p-xylene p-Methylbenzyl alcohol p-Tolyl alcohol p-Tolylcarbinol
kegg.compound:C06757 keggC:C06757 KMTDMTZBNYGUNX-UHFFFAOYSA-N	4-Methylbenzyl alcohol 4-Tolylcarbinol alpha-Hydroxy-p-xylene
seed.compound:cpd04137 seedM:cpd04137 KMTDMTZBNYGUNX-UHFFFAOYSA-N	4-Tolylcarbinol 4-(hydroxymethyl)toluene 4-Methylbenzyl alcohol 4-methyl-benzenemethanol 4-methylbenzyl alcohol 4-tolylcarbinol 4mbzalc alpha-Hydroxy-p-xylene p-methylbenzyl alcohol p-tolyl alcohol p-tolylcarbinol
bigg.metabolite:4mbzalc biggM:4mbzalc	4-methylbenzyl alcohol
metacyc.compound:4-METHYLBENZYL-ALCOHOL metacycM:4-METHYLBENZYL-ALCOHOL KMTDMTZBNYGUNX-UHFFFAOYSA-N	4-methylbenzyl alcohol 4-(hydroxymethyl)toluene 4-methyl-benzenemethanol 4-tolylcarbinol alpha-Hydroxy-p-xylene p-methylbenzyl alcohol p-tolyl alcohol p-tolylcarbinol
sabiork.compound:2919 sabiorkM:2919 KMTDMTZBNYGUNX-UHFFFAOYSA-N	alpha-Hydroxy-p-xylene 4-Methylbenzyl alcohol 4-Tolylcarbinol
envipath:...a872fea34d8a envipathM:...a872fea34d8a KMTDMTZBNYGUNX-UHFFFAOYSA-N	compound 0056125
envipath:...1b7e5c3aab71 envipathM:...1b7e5c3aab71 KMTDMTZBNYGUNX-UHFFFAOYSA-N	p-Methylbenzyl alcohol
hmdb:HMDB41609 chebi:25828 biggM:M_4mbzalc keggC:M_C06757 seedM:M_cpd04137 vmhM:M_4mboh	secondary/obsolete/fantasy identifier