Metabolite List

all metabolites that has the same formula 'C6H14O'

1-Hexanol (BioCAD00000025503)
Formula: C6H14O (Exact Mass: 102.1045)

1-Hexanol is an organic alcohol with a six carbon chain and a condensed structural formula of CH3(CH2)5OH. This colorless liquid is slightly soluble in water, but miscible with ether and ethanol. Two additional straight chain isomers of 1-hexanol exist, 2-hexanol and 3-hexanol, both of which differ by the location of the hydroxyl group. Many isomeric alcohols have the formula C6H13OH. 1-hexanol is believed to be a component of the odour of freshly mown grass. It is used in the perfume industry.

plant natural products marine natural products
2-Ethoxybutane (BioCAD00000028705)
Formula: C6H14O (Exact Mass: 102.1045)

2-Ethoxybutane is a flavouring agent

plant natural products
3-Hexanol (BioCAD00000028832)
Formula: C6H14O (Exact Mass: 102.1045)

3-Hexanol, also known as fema 3351 or 3-hexyl alcohol, belongs to the class of organic compounds known as secondary alcohols. Secondary alcohols are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl). 3-Hexanol is an alcoholic, ether, and medicinal tasting compound. 3-Hexanol is found, on average, in the highest concentration within safflowers. 3-Hexanol has also been detected, but not quantified, in several different foods, such as green bell peppers, orange bell peppers, pepper (c. annuum), red bell peppers, and yellow bell peppers.

saliva
(±)-3-Methyl-1-pentanol (BioCAD00000030661)
Formula: C6H14O (Exact Mass: 102.1045)

(±)-3-Methyl-1-pentanol, also known as 3-ethylbutanol or 3-methyl-(+/-)-1-pentanol, belongs to the class of organic compounds known as primary alcohols. Primary alcohols are compounds comprising the primary alcohol functional group, with the general structure RCOH (R=alkyl, aryl). (±)-3-Methyl-1-pentanol is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. Thus, (±)-3-Methyl-1-pentanol is considered to be a fatty alcohol lipid molecule. (±)-3-Methyl-1-pentanol is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. (±)-3-Methyl-1-pentanol is a cocoa, cognac, and fruity tasting compound. (±)-3-Methyl-1-pentanol has been detected, but not quantified, in cornmints.

feces
Isohexanol (BioCAD00000055355)
Formula: C6H14O (Exact Mass: 102.1045)

Isohexanol, also known as 4-methylpentanol or isohexyl alcohol, belongs to the class of organic compounds known as primary alcohols. Primary alcohols are compounds comprising the primary alcohol functional group, with the general structure RCOH (R=alkyl, aryl). Isohexanol is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. Thus, isohexanol is considered to be a fatty alcohol lipid molecule. These are compounds comprising the primary alcohol functional group, with the general strucuture RCOH (R=alkyl, aryl).

plant natural products
2-Hexanol (BioCAD00000056620)
Formula: C6H14O (Exact Mass: 102.1045)

2-Hexanol, also known as hexan-2-ol, belongs to the class of organic compounds known as secondary alcohols. Secondary alcohols are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl). 2-Hexanol is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. Thus, 2-hexanol is considered to be a fatty alcohol lipid molecule. 2-Hexanol (or hexan-2-ol) is a six carbon alcohol in which the OH group is located on the second carbon atom. Its chemical formula is C6H14O or C6H13OH. 2-Hexanol is a chemical and winey tasting compound. 2-Hexanol is found, on average, in the highest concentration within safflowers. 2-Hexanol has also been detected, but not quantified, in several different foods, such as pepper (c. frutescens), tea, green bell peppers, corns, and orange bell peppers. This could make 2-hexanol a potential biomarker for the consumption of these foods. 2-Hexanol, with regard to humans, has been linked to the inborn metabolic disorder celiac disease. It is an isomer of the other hexanols. 2-Hexanol has a chiral center and can be resolved into enantiomers.

saliva plant natural products
3-methyl-2-pentanol (BioCAD00000057036)
Formula: C6H14O (Exact Mass: 102.1045)

3-methyl-2-pentanol, also known as 2-Hydroxy-3-methylpentane, is classified as a member of the Secondary alcohols. Secondary alcohols are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl). 3-methyl-2-pentanol is considered to be soluble (in water) and basic. 3-methyl-2-pentanol can be found in Tea

3,3-Dimethyl-2-butanol (BioCAD00000175913)
Formula: C6H14O (Exact Mass: 102.1045)

3,3-Dimethyl-2-butanol is a metabolite found in or produced by Saccharomyces cerevisiae.

4-Methyl-2-pentanol (BioCAD00000176358)
Formula: C6H14O (Exact Mass: 102.1045)

Methyl isobutyl carbinol appears as a clear colorless liquid. Flash point 120 °F. Less dense than water. Vapors heavier than air. 4-Methyl-2-pentanol is a natural product found in Eucalyptus loxophleba and Cinnamomum camphora with data available.

plant natural products
Diisopropyl ether (BioCAD00000180233)
Formula: C6H14O (Exact Mass: 102.1045)

Diisopropyl ether appears as a clear colorless liquid with an ethereal odor. Flash point -18 °F. Less dense than water. Vapors heavier than air.

blood
Dipropyl ether (BioCAD00000180330)
Formula: C6H14O (Exact Mass: 102.1045)

Di-n-propyl ether appears as a colorless liquid with a strong odor. Less dense than water and slightly soluble in water. Vapors are heavier than air. In high concentrations the vapors may be narcotic.

blood
Tert-Amyl methyl ether (BioCAD00000186126)
Formula: C6H14O (Exact Mass: 102.1045)

Tert-Butyl ethyl ether (BioCAD00000186131)
Formula: C6H14O (Exact Mass: 102.1045)

2-methyl-2-ethoxypropane is a clear light yellow liquid. (NTP, 1992) Tert-butyl ethyl ether is an ether having ethyl and tert-butyl as the two alkyl components. It is used as an engine fuel additive to reduce emissions of carbon monoxide and soot. It has a role as a fuel additive. It is an ether and a volatile organic compound. tert-Butyl ethyl ether is a natural product found in Tuber borchii with data available.

2-Methylpentan-3-ol (BioCAD00000229179)
Formula: C6H14O (Exact Mass: 102.1045)

2-methylpentan-3-ol is a member of the class of compounds known as secondary alcohols. Secondary alcohols are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl). 2-methylpentan-3-ol is soluble (in water) and an extremely weak acidic compound (based on its pKa). 2-methylpentan-3-ol can be found in tea, which makes 2-methylpentan-3-ol a potential biomarker for the consumption of this food product.

2-Methylpentan-2-ol (BioCAD00000229227)
Formula: C6H14O (Exact Mass: 102.1045)

2-methylpentan-2-ol is a member of the class of compounds known as tertiary alcohols. Tertiary alcohols are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H ). 2-methylpentan-2-ol is soluble (in water) and an extremely weak acidic compound (based on its pKa). 2-methylpentan-2-ol is a pungent tasting compound and can be found in a number of food items such as red bell pepper, pepper (c. annuum), orange bell pepper, and apple, which makes 2-methylpentan-2-ol a potential biomarker for the consumption of these food products.

plant natural products
3-Methylpentan-3-ol (BioCAD00000229231)
Formula: C6H14O (Exact Mass: 102.1045)

3-methylpentan-3-ol is a member of the class of compounds known as tertiary alcohols. Tertiary alcohols are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H ). Thus, 3-methylpentan-3-ol is considered to be a fatty alcohol lipid molecule. 3-methylpentan-3-ol is soluble (in water) and an extremely weak acidic compound (based on its pKa). 3-methylpentan-3-ol is a fruity, green, and leafy tasting compound and can be found in a number of food items such as green bell pepper, pepper (c. annuum), orange bell pepper, and red bell pepper, which makes 3-methylpentan-3-ol a potential biomarker for the consumption of these food products.

Hexanol (BioCAD00000234292)
Formula: C6H14O (Exact Mass: 102.1045)

Methylpentanol (BioCAD00000234298)
Formula: C6H14O (Exact Mass: 102.1045)

Hexan-3S-ol (BioCAD00000430284)
Formula: C6H14O (Exact Mass: 102.1045)

Hexan-3S-ol

plant natural products
3-methylpentanol (BioCAD00000540598)
Formula: C6H14O (Exact Mass: 102.1045)

A primary alcohol that is pentanol substituted by a methyl group at position 3." []