KEGG   DRUG: Anetholtrithion
Entry
D01584                      Drug                                   
Name
Anetholtrithion (JAN);
Athenentol (TN)
Formula
C10H8OS3
Exact mass
239.9737
Mol weight
240.37
Structure
Remark
ATC code: A16AX02
Efficacy
Salivation accelaletor
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A16 OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
   A16A OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
    A16AX Various alimentary tract and metabolism products
     A16AX02 Anethole trithione
      D01584  Anetholtrithion (JAN)
Other DBs
CAS: 532-11-6
PubChem: 7848647
ChEBI: 31221
LigandBox: D01584
NIKKAJI: J33.400F
LinkDB
KCF data

ATOM        14
            1   C8y C    26.8196  -15.7388
            2   S3x S    27.2553  -14.4085
            3   S3x S    26.1198  -13.5827
            4   C8y C    24.9844  -14.4085
            5   C8x C    25.4199  -15.7388
            6   C8y C    21.3551  -12.3031
            7   C8x C    21.3551  -13.7028
            8   C8x C    22.5703  -14.4027
            9   C8y C    23.7783  -13.7028
            10  C8x C    23.7783  -12.3031
            11  C8x C    22.5703  -11.6033
            12  O2a O    20.1432  -11.6026
            13  C1a C    18.9308  -12.3019
            14  S0  S    27.6410  -16.8722
BOND        15
            1     3   4 1
            2     4   5 2
            3     5   1 1
            4     6   7 2
            5     7   8 1
            6     8   9 2
            7     9  10 1
            8    10  11 2
            9    11   6 1
            10    9   4 1
            11    6  12 1
            12    1   2 1
            13   12  13 1
            14    2   3 1
            15    1  14 2

» Japanese version   » Back

DBGET integrated database retrieval system