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Taurine for biochemistry

CAT: 1288-2116GR500Size: 500 gDry Ice: NoHazardous: No
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CAS Number
107-35-7

Chemical Information

Taurine

Taurine is an amino sulfonic acid that is the 2-amino derivative of ethanesulfonic acid. It is a naturally occurring amino acid derived from methionine and cysteine metabolism. An abundant component of fish- and meat-based foods, it has been used as an oral supplement in the treatment of disorders such as cystic fibrosis and hypertension. It has a role as an antioxidant, a nutrient, a radical scavenger, a glycine receptor agonist, a mouse metabolite, a Saccharomyces cerevisiae metabolite, an Escherichia coli metabolite and a human metabolite. It is a conjugate acid of a 2-aminoethanesulfonate. It is a tautomer of a taurine zwitterion.

CAS Number107-35-7
PubChem CID1123
IUPAC Name2-aminoethanesulfonic acid
Molecular FormulaC2H7NO3S
Molecular Weight125.15
XLogP-4.1
Topological Polar Surface Area88.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count7
Formal Charge0
Complexity120
SMILES
C(CS(=O)(=O)O)N
InChI
InChI=1S/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)
InChIKey
XOAAWQZATWQOTB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Taurine
CAS: 107-35-7
CID: 1123
Formula: C2H7NO3S
MW: 125.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight125.15
XLogP3-4.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass125.01466426
Monoisotopic Mass125.01466426
Topological Polar Surface Area88.8 Ų
Heavy Atom Count7
Formal Charge0
Complexity120
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
FT29795-01Taurine

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