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Details

Stereochemistry ACHIRAL
Molecular Formula C5H12
Molecular Weight 72.1488
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PENTANE

SMILES

CCCCC

InChI

InChIKey=OFBQJSOFQDEBGM-UHFFFAOYSA-N
InChI=1S/C5H12/c1-3-5-4-2/h3-5H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C5H12
Molecular Weight 72.1488
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Description

Pentane, an organic compound, an indicator of lipid peroxidation. Its normal concentration in the breath of healthy humans is lower than 10 pmoles/l. Breath pentane, which is produced by reactive oxygen species-mediated lipid peroxidation of n-6 polyunsaturated membrane fatty acids, is a marker of oxidative stress. Experiments on animals have shown that the breath pentane analysis could provide early, rapid, noninvasive and continuous assessment of lipid peroxidation during hepatic ischemia-reperfusion injury.

Approval Year

PubMed

Substance Class Chemical
Record UNII
4FEX897A91
Record Status Validated (UNII)
Record Version