KEGG   COMPOUND: C00245Help
Entry
C00245                      Compound                               

Name
Taurine;
2-Aminoethanesulfonic acid;
Aminoethylsulfonic acid
Formula
C2H7NO3S
Exact mass
125.0147
Mol weight
125.1469
Structure
Mol fileKCF fileDB search
Remark
Same as: D00047
Reaction
Pathway
map00120  Primary bile acid biosynthesis
map00430  Taurine and hypotaurine metabolism
map00920  Sulfur metabolism
map01100  Metabolic pathways
map02010  ABC transporters
map04080  Neuroactive ligand-receptor interaction
Enzyme
1.4.2.-         1.4.99.2        1.5.1.23        1.8.1.3         
1.14.11.17      2.1.4.1         2.3.1.65        2.3.2.2         
2.6.1.55        2.6.1.77        3.5.1.24        3.5.1.74        
4.1.1.15        4.1.1.29
Brite
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  21  Cardiovascular agents
   211  Cardiotonics
    2119  Others
     D00047  Taurine (JP17/USP/INN); Aminoethylsulfonic acid (JAN)
 3  Agents affecting metabolism
  39  Other agents affecting metabolism
   391  Liver disease agents
    3919  Others
     D00047  Taurine (JP17/USP/INN); Aminoethylsulfonic acid (JAN)
Classification of Japanese OTC drugs [BR:br08313]
 Agents for ophthalmologic use
  62 General eye drops
   D00047  Taurine (JP17/USP/INN)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   Aminoethylsulfonic acid; Taurine
    D00047  Taurine (JP17/USP/INN)
Pharmaceutical additives in Japan [BR:br08316]
 Stabilizing agent
  D00047  [002019] Taurine
 Buffering agent
  D00047  [002019] Taurine
 Flavoring substance
  D00047  [002019] Taurine
 Bonding agent
  D00047  [002019] Taurine
 Tonicity agent
  D00047  [002019] Taurine
 Diluting agent
  D00047  [002019] Taurine
 Antiseptic agent
  D00047  [002019] Taurine
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00047  Taurine
Animal drugs in Japan [BR:br08331]
 96  Agents affecting metabolism
  967  Agents for liver disease and antidotes
   9674  Taurine and preparations
    C00245  Aminoethylsulfonic acid
BRITE hierarchy
Other DBs
CAS: 107-35-7
PubChem: 3544
ChEBI: 15891
ChEMBL: CHEMBL239243
KNApSAcK: C00048188
PDB-CCD: TAU[PDBj]
3DMET: B00069
NIKKAJI: J5.056C
LinkDB All DBs
KCF data Show

ATOM        7
            1   C1b C    26.3067  -17.5328
            2   S4a S    27.5163  -16.8350
            3   C1b C    25.0914  -16.8350
            4   O1d O    28.7256  -17.5328
            5   N1a N    23.8820  -17.5328
            6   O1d O    28.6445  -15.9863
            7   O1d O    26.3056  -16.1360
BOND        6
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     2   6 2
            6     2   7 2

» Japanese version

DBGET integrated database retrieval system