| 1 | taurine |
| 2 | 2-aminoethanesulfonic acid |
| 3 | Ethanesulfonic acid, 2-amino- |
| 4 | tauphon |
| 5 | L-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 a human metabolite, an antioxidant, a mouse metabolite, a Saccharomyces cerevisiae metabolite, an Escherichia coli metabolite, a glycine receptor agonist, a nutrient and a radical scavenger. It is a conjugate acid of a 2-aminoethanesulfonate. It is a tautomer of a taurine zwitterion.
| Molecular Formula | C2H7NO3S |
|---|---|
| Canonical SMILES | C(CS(=O)(=O)O)N |
| Isomeric SMILES | C(CS(=O)(=O)O)N |
| Molecular Weight | 125.1500 |
| InChIKey | XOAAWQZATWQOTB-UHFFFAOYSA-N |
| InChI | InChI=1S/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6) |
| XLogP | -4.1000 |
| ExactMass | 125.0147 |
| MonoisotopicMass | 125.0147 |
| TPSA | 88.8000 |
| Complexity | 120.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 2 |
| HBondAcceptorCount | 4 |
| RotatableBondCount | 2 |
| HeavyAtomCount | 7 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 46685 |
| PatentFamilyCount | 20272 |
| LiteratureCount | 25911 |