KEGG   COMPOUND: C06541Help
Entry
C06541                      Compound                               

Name
Deserpidine
Formula
C32H38N2O8
Exact mass
578.2628
Mol weight
578.6527
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tryptophan and anthranilic acid
   Indole alkaloids
    C06541  Deserpidine
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C02 ANTIHYPERTENSIVES
   C02A ANTIADRENERGIC AGENTS, CENTRALLY ACTING
    C02AA Rauwolfia alkaloids
     C02AA05 Deserpidine
      D08194  Deserpidine (INN)
BRITE hierarchy
Other DBs
CAS: 
131-01-1
PubChem: 
ChEBI: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        42
            1   C8x C    16.5900  -17.0100
            2   C8x C    16.5900  -18.4800
            3   C8x C    17.8500  -19.1800
            4   C8y C    19.0400  -18.4800
            5   C8y C    19.0400  -17.0100
            6   C8x C    17.8500  -16.3100
            7   N4x N    20.3700  -18.9000
            8   C8y C    21.2100  -17.7100
            9   C8y C    20.3700  -16.5900
            10  C1y C    22.6100  -17.5700
            11  N1y N    23.1700  -16.3100
            12  C1x C    22.3300  -15.1900
            13  C1x C    20.9300  -15.3300
            14  C1x C    23.4500  -18.7600
            15  C1y C    24.8500  -18.6200
            16  C1y C    25.4100  -17.2900
            17  C1x C    24.5700  -16.1700
            18  C1y C    25.6200  -19.7400
            19  C1y C    27.0200  -19.6000
            20  C1y C    27.5800  -18.2700
            21  C1x C    26.8100  -17.1500
            22  C7a C    25.0600  -21.0000
            23  O6a O    23.7300  -21.0000
            24  O7a O    25.9000  -22.1200
            25  O2a O    27.8600  -20.7200
            26  C1a C    29.2600  -20.7200
            27  C1a C    27.3000  -22.1200
            28  O7a O    29.0500  -18.2700
            29  C7a C    29.6800  -17.0800
            30  C8y C    31.1500  -17.0800
            31  C8x C    31.8500  -18.2700
            32  C8y C    33.2500  -18.2700
            33  C8y C    33.9500  -17.0100
            34  C8y C    33.2500  -15.8200
            35  C8x C    31.8500  -15.8200
            36  O6a O    28.9800  -15.8200
            37  O2a O    33.9500  -14.6300
            38  C1a C    35.3500  -14.7000
            39  O2a O    35.3500  -17.0100
            40  O2a O    33.9500  -19.4600
            41  C1a C    35.3500  -19.4600
            42  C1a C    36.0500  -15.8200
BOND        47
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 2
            10    5   9 1
            11    8  10 1
            12   10  11 1
            13   11  12 1
            14   12  13 1
            15    9  13 1
            16   10  14 1
            17   14  15 1
            18   15  16 1
            19   16  17 1
            20   11  17 1
            21   15  18 1
            22   18  19 1
            23   19  20 1
            24   20  21 1
            25   16  21 1
            26   18  22 1 #Up
            27   22  23 2
            28   22  24 1
            29   19  25 1 #Down
            30   25  26 1
            31   24  27 1
            32   20  28 1 #Up
            33   28  29 1
            34   29  30 1
            35   30  31 2
            36   31  32 1
            37   32  33 2
            38   33  34 1
            39   34  35 2
            40   30  35 1
            41   29  36 2
            42   34  37 1
            43   37  38 1
            44   33  39 1
            45   32  40 1
            46   40  41 1
            47   39  42 1

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