KEGG   DRUG: Guanoxan sulfate
Entry
D04399                      Drug                                   

Name
Guanoxan sulfate (USAN);
Envacar (TN)
Formula
(C10H13N3O2)2. H2SO4
Exact mass
512.1689
Mol weight
512.5367
Structure
Class
Cardiovascular agent
 DG01739  Peripherally-acting antiadrenergic
Remark
ATC code: C02CC03
Efficacy
Antihypertensive
Comment
Guanidine derivative, Benzodioxan derivative
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C02 ANTIHYPERTENSIVES
   C02C ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
    C02CC Guanidine derivatives
     C02CC03 Guanoxan
      D04399  Guanoxan sulfate (USAN)
Other DBs
CAS: 5714-04-5
PubChem: 47206282
ChEMBL: CHEMBL1742462
LigandBox: D04399
LinkDB
KCF data

ATOM        35
            1   C8x C    11.4800  -15.4700
            2   C8x C    11.4800  -16.8700
            3   C8x C    12.6924  -17.5700
            4   C8y C    13.9049  -16.8700
            5   C8y C    13.9049  -15.4700
            6   C8x C    12.6924  -14.7700
            7   O2x O    15.1173  -17.5700
            8   C1x C    16.3297  -16.8700
            9   C1y C    16.3297  -15.4700
            10  O2x O    15.1173  -14.7700
            11  C1b C    17.5273  -14.7785
            12  N1b N    18.7156  -15.4645
            13  C2c C    19.9064  -14.7769
            14  N1a N    21.0960  -15.4637
            15  N2a N    19.9064  -13.3702
            16  S4a S    27.9644  -15.3536
            17  O1d O    27.9644  -13.9517
            18  O1d O    27.9644  -16.7556
            19  O1d O    26.5625  -15.3536
            20  O1d O    29.3664  -15.3536
            21  C8x C    11.4800  -15.4700
            22  C8x C    11.4800  -16.8700
            23  C8x C    12.6924  -17.5700
            24  C8y C    13.9049  -16.8700
            25  C8y C    13.9049  -15.4700
            26  C8x C    12.6924  -14.7700
            27  O2x O    15.1173  -14.7700
            28  C1y C    16.3297  -15.4700
            29  C1x C    16.3297  -16.8700
            30  O2x O    15.1173  -17.5700
            31  C1b C    17.5273  -14.7785
            32  N1b N    18.7156  -15.4645
            33  C2c C    19.9064  -14.7769
            34  N1a N    21.0960  -15.4637
            35  N2a N    19.9064  -13.3702
BOND        36
            1    16  17 2
            2    16  18 2
            3    16  19 1
            4    16  20 1
            5     1   2 2
            6     2   3 1
            7     3   4 2
            8     4   5 1
            9     5   6 2
            10    1   6 1
            11    4   7 1
            12    7   8 1
            13    8   9 1
            14    9  10 1
            15    5  10 1
            16    9  11 1
            17   11  12 1
            18   12  13 1
            19   13  14 1
            20   13  15 2
            21   21  22 2
            22   22  23 1
            23   23  24 2
            24   24  25 1
            25   25  26 2
            26   21  26 1
            27   24  30 1
            28   30  29 1
            29   29  28 1
            30   28  27 1
            31   25  27 1
            32   28  31 1
            33   31  32 1
            34   32  33 1
            35   33  34 1
            36   33  35 2
BRACKET     1    10.2900  -18.4800   10.2900  -11.9000
            1    23.5900  -11.9000   23.5900  -18.4800
            1  2
 ORIGINAL  1    1   2   3   4   5   6  10   9   8   7  11  12  13  14  15
 REPEAT    1   21  22  23  24  25  26  27  28  29  30  31  32  33  34  35

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