2-methylpropane-1,2-diol (CHEBI:131845)

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ChEBI Name	2-methylpropane-1,2-diol

ChEBI ID	CHEBI:131845

Definition	A glycol that is 2-methylpropane in which the two hydroxy groups are located at positions 1 and 2..

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	Kristian Axelsen

Supplier Information

Download	Molfile XML SDF

Formula

C4H10O2

Net Charge

Average Mass

90.121

Monoisotopic Mass

90.06808

InChI

InChI=1S/C4H10O2/c1-4(2,6)3-5/h5-6H,3H2,1-2H3

InChIKey

BTVWZWFKMIUSGS-UHFFFAOYSA-N

SMILES

OCC(C)(O)C

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	See: PubMed
Rattus norvegicus (NCBI:txid10116)	See: PubMed
Mycobacterium sp. (NCBI:txid1547487)	of strain ELW1 See: PubMed
Mycobacterium austroafricanum (NCBI:txid39687)	of strain IFP 2015 See: PubMed
Homo sapiens (NCBI:txid9606)	See: PubMed

Roles Classification
Biological Role(s):	mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). rat metabolite Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus). human urinary metabolite Any metabolite (endogenous or exogenous) found in human urine samples. human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. bacterial xenobiotic metabolite Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.

ChEBI Ontology
Outgoing	2-methylpropane-1,2-diol (CHEBI:131845) has parent hydride isobutane (CHEBI:30363) 2-methylpropane-1,2-diol (CHEBI:131845) has role bacterial xenobiotic metabolite (CHEBI:76976) 2-methylpropane-1,2-diol (CHEBI:131845) has role human urinary metabolite (CHEBI:84087) 2-methylpropane-1,2-diol (CHEBI:131845) has role human xenobiotic metabolite (CHEBI:76967) 2-methylpropane-1,2-diol (CHEBI:131845) has role mouse metabolite (CHEBI:75771) 2-methylpropane-1,2-diol (CHEBI:131845) has role rat metabolite (CHEBI:86264) 2-methylpropane-1,2-diol (CHEBI:131845) is a glycol (CHEBI:13643) 2-methylpropane-1,2-diol (CHEBI:131845) is a primary alcohol (CHEBI:15734) 2-methylpropane-1,2-diol (CHEBI:131845) is a tertiary alcohol (CHEBI:26878)

IUPAC Name

2-methylpropane-1,2-diol

Last Modified

19 July 2016