KEGG   COMPOUND: C18377
Entry
C18377                      Compound                               
Name
Thiamine disulfide
Formula
C24H34N8O4S2
Exact mass
562.2144
Mol weight
562.708
Structure
Remark
Same as: D03299
Brite
Therapeutic category of drugs in Japan [BR:br08301]
 3  Agents affecting metabolism
  31  Vitamins
   312  Vitamin B1 preparations
    3122  Vitamin B1 derivatives
     D03299  Thiamine disulfide (JAN)
Classification of Japanese OTC drugs [BR:br08313]
 Nourishing tonics and health supplements
  35 Vitamin B1 based drugs
   D03299  Thiamine disulfide (JAN)
  42 Vitamin B1B6B12 based drugs
   D03299  Thiamine disulfide (JAN)
  43 Vitamin containing supplements
   D03299  Thiamine disulfide (JAN)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   Thiamine disulfide
    D03299  Thiamine disulfide (JAN)
Animal drugs in Japan [BR:br08331]
 96  Agents affecting metabolism
  962  Vitamin preparations
   9622  Vitamin B1 and preparations
    C18377  Thiamine disulfide
Other DBs
PubChem: 124489051
ChEBI: 81715
LinkDB
KCF data

ATOM        38
            1   C8y C    14.7000  -23.3800
            2   N5x N    14.7000  -21.9800
            3   C8y C    15.8900  -21.2800
            4   C8y C    17.0800  -21.9800
            5   C8x C    17.0800  -23.3800
            6   N5x N    15.8900  -24.0800
            7   C1b C    18.3400  -21.2800
            8   N1c N    19.5300  -21.9800
            9   C2c C    19.5300  -23.3800
            10  C1a C    13.4400  -24.0800
            11  N1a N    15.8900  -19.8800
            12  C1a C    18.3400  -24.0800
            13  C4a C    20.7200  -21.2800
            14  C2c C    20.7200  -24.0800
            15  O4a O    21.9100  -21.9800
            16  S3a S    21.9100  -23.3800
            17  C1b C    20.7200  -25.4800
            18  C1b C    19.5300  -26.1800
            19  O1a O    18.3400  -25.4800
            20  S3a S    23.1000  -24.0800
            21  C2c C    24.2900  -23.3800
            22  C2c C    25.4800  -24.0800
            23  C1b C    24.2900  -21.9800
            24  C1b C    25.4800  -21.2800
            25  O1a O    26.6700  -21.9800
            26  C1a C    26.6700  -23.3800
            27  N1c N    25.4800  -25.4800
            28  C4a C    24.2900  -26.1800
            29  C1b C    26.6700  -26.1800
            30  O4a O    23.1000  -25.4800
            31  C8y C    27.8600  -25.4800
            32  C8y C    29.0500  -26.1800
            33  N5x N    30.3100  -25.4800
            34  C8y C    30.3100  -24.0800
            35  N5x N    29.1200  -23.3800
            36  C8x C    27.8600  -24.0800
            37  C1a C    31.5000  -23.3800
            38  N1a N    29.0500  -27.5800
BOND        39
            1     1   2 1
            2     7   8 1
            3     2   3 2
            4     3   4 1
            5     8   9 1
            6     4   5 2
            7     5   6 1
            8     6   1 2
            9     1  10 1
            10    4   7 1
            11    3  11 1
            12    9  12 1
            13    8  13 1
            14    9  14 2
            15   13  15 2
            16   14  16 1
            17   14  17 1
            18   17  18 1
            19   18  19 1
            20   16  20 1
            21   20  21 1
            22   21  22 2
            23   21  23 1
            24   23  24 1
            25   24  25 1
            26   22  26 1
            27   22  27 1
            28   27  28 1
            29   27  29 1
            30   28  30 2
            31   29  31 1
            32   31  32 1
            33   32  33 2
            34   33  34 1
            35   34  35 2
            36   35  36 1
            37   31  36 2
            38   34  37 1
            39   32  38 1

» Japanese version

DBGET integrated database retrieval system