KEGG   COMPOUND: C13229
Entry
C13229                      Compound                               
Name
Sulpyrine;
Dipyrone monohydrate;
Dipyrone
Formula
C13H16N3O4S. Na. H2O
Exact mass
351.0865
Mol weight
351.3539
Structure
Remark
Same as: D01762
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N02 ANALGESICS
   N02B OTHER ANALGESICS AND ANTIPYRETICS
    N02BB Pyrazolones
     N02BB02 Metamizole sodium
      D01762  Dipyrone (USAN) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
 1  Agents affecting nervous system and sensory organs
  11  Agents affecting central nervous system
   114  Antipyretics and analgesics, anti-inflammatory agents
    1144  Pyrazolones
     D01762  Dipyrone (USAN); Sulpyrine hydrate (JP18)
Animal drugs in Japan [BR:br08331]
 91  Agents affecting nervous system
  913  Antipyretics, analgesics and antiinflammatory
   9132  Pyrazolone, derivatives and preparations
    C13229  Sulpyrine hydrate
Drug groups [BR:br08330]
 Anti-inflammatory
  DG01504  Nonsteroidal anti-inflammatory drug (NSAID)
   DG01947  Anti-inflammatory drug, pyrazolone
    DG00827  Metamizole sodium
     D01762  Dipyrone
Drug classes [BR:br08332]
 Anti-inflammatory
  DG01504  Nonsteroidal anti-inflammatory drug (NSAID)
   D01762  Dipyrone
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D01762  Sulpyrine hydrate
  D01762  Sulpyrine injection
Other DBs
CAS: 5907-38-0
PubChem: 585973
ChEBI: 32169
KCF data

ATOM        23
            1   Z   Na   34.1465  -16.1520 #+
            2   O0  O    38.2530  -16.0769
            3   C8x C    22.0595  -16.2849
            4   C8x C    22.0595  -17.6767
            5   C8x C    23.2649  -18.3727
            6   C8x C    24.4703  -17.6767
            7   C8y C    24.4703  -16.2849
            8   C8x C    23.2649  -15.5889
            9   N4y N    25.6943  -15.5780
            10  N4y N    25.6943  -14.1861
            11  C1a C    24.4819  -13.4860
            12  C8y C    27.0180  -16.0081
            13  C8y C    27.8362  -14.8821
            14  C8y C    27.0180  -13.7560
            15  N1c N    29.2276  -14.8821
            16  O5x O    27.4459  -17.3252
            17  C1a C    27.4394  -12.4586
            18  C1a C    29.9188  -13.4761
            19  C1b C    29.9282  -16.0957
            20  S4a S    31.3201  -16.0957
            21  O1d O    32.7120  -16.0957 #-
            22  O1d O    31.3202  -14.6842
            23  O1d O    31.3201  -17.4680
BOND        22
            1     3   4 2
            2     4   5 1
            3     5   6 2
            4     6   7 1
            5     7   8 2
            6     3   8 1
            7     7   9 1
            8     9  10 1
            9    10  11 1
            10    9  12 1
            11   12  13 1
            12   13  14 2
            13   10  14 1
            14   13  15 1
            15   12  16 2
            16   14  17 1
            17   15  18 1
            18   15  19 1
            19   19  20 1
            20   20  21 1
            21   20  22 2
            22   20  23 2

» Japanese version

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Drug (1)   
   KEGG DRUG (1)   
Chemical substance (2)   
   PubChem (1)   
   ChEBI (1)   
All databases (3)   

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