bmse000120 Taurine at BMRB

Taurine

O-Due; Taurina [Spanish]; L-Taurine; 2-Sulfoethylamine; Taurinum [Latin]; Aminoethanesulfonic acid; Aminoethylsulfonic acid; Taurine; 2-Aminoethanesulfonic acid; beta-Aminoethylsulfonic acid; Ethanesulfonic acid, 2-amino-

Molecular Formula: C2 H7 N O3 S
Natural Isotopic Abundance Mass: 125.1468800000
Mono-Isotopic Molecular Masses: C12N14: 125.014663786; C13N14: 127.021373462; C12N15: 126.011698679; C13N15: 128.018408355

Taurine

InCHi String:
InChI=1S/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)

isomeric and canonical SMILES:
C(CS(=O)(=O)O)N

IUPAC
2-aminoethanesulfonic acid

PubChem Substance (SID):   85164954   150971   3544
PubChem Compound (CID):   1123
KEGG: Compound ID   C00245
CAS Registry IDs:   107-35-7   91105-79-2
PDB Chemical Component   TAU
Miscellaneous Databases and IDs:   CHEBI 15891   NSC 32428   EINECS 203-483-8   CCRIS 4721   FEMA No. 3813

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.