KEGG   COMPOUND: C09201Help
Entry
C09201                      Compound                               

Name
Tinyatoxin
Formula
C36H38O8
Exact mass
598.2567
Mol weight
598.6821
Structure
Mol fileKCF fileDB searchJmolKegDraw
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Diterpenoids (C20)
   Daphnanes
    C09201  Tinyatoxin
Target-based classification of compounds [BR:br08010]
 Ion channels
  Related to voltage-gated cation channels
   Transient receptor potential family, TRPV (Vanilloid)
    transient receptor potential cation channel, subfamily V, member 1
     C09201  Tinyatoxin
BRITE hierarchy
Other DBs
CAS: 
58821-95-7
PubChem: 
ChEBI: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        44
            1   C1z C    23.1700  -17.1500
            2   C1y C    24.3600  -17.7100
            3   C1y C    21.9800  -17.7100
            4   O2x O    24.0800  -16.5200
            5   C1y C    23.1700  -15.8200
            6   C1y C    25.4800  -17.0100
            7   C2x C    24.6400  -18.9700
            8   C1z C    21.7000  -18.9700
            9   C2x C    20.8600  -17.0100
            10  C1z C    25.3400  -12.6700
            11  C1x C    24.2200  -15.0500
            12  C1a C    21.9100  -15.2600
            13  C1z C    25.4800  -15.6800
            14  O2x O    27.0900  -17.2900
            15  C2y C    23.8000  -20.0200
            16  C1x C    22.5400  -20.0200
            17  C5x C    20.3700  -18.9700
            18  O1a O    21.4200  -20.3700
            19  C2y C    19.8800  -17.8500
            20  O2x O    25.3400  -14.6300
            21  C2c C    27.0900  -14.8400
            22  O5x O    19.7400  -20.1600
            23  C1a C    18.6200  -17.5700
            24  C1a C    27.0900  -13.5800
            25  C2a C    28.2100  -15.5400
            26  C1b C    25.3400  -11.2700
            27  C8y C    26.5524  -10.5700
            28  C8x C    27.7479  -11.2604
            29  C8x C    28.9604  -10.5605
            30  C8x C    28.9606   -9.1605
            31  C8x C    27.7651   -8.4701
            32  C8x C    26.5526   -9.1700
            33  C1b C    25.0124  -20.7200
            34  O7a O    26.2249  -20.0200
            35  C7a C    27.4373  -20.7200
            36  C1b C    28.6497  -20.0200
            37  C8y C    29.8622  -20.7200
            38  C8x C    29.8622  -22.1197
            39  C8x C    31.0746  -22.8197
            40  C8y C    32.2871  -22.1197
            41  C8x C    32.2870  -20.7200
            42  C8x C    31.0746  -20.0200
            43  O6a O    27.4373  -22.1200
            44  O1a O    33.4868  -22.8124
BOND        50
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     1   5 1
            5     2   6 1
            6     2   7 1
            7     3   8 1
            8     3   9 1
            9     4  10 1
            10    5  11 1
            11    5  12 1 #Down
            12    6  13 1
            13    6  14 1 #Down
            14    7  15 2
            15    8  16 1
            16    8  17 1
            17    8  18 1 #Up
            18    9  19 2
            19   10  20 1
            20   13  21 1 #Up
            21   17  22 2
            22   19  23 1
            23   21  24 1
            24   21  25 2
            25   10  14 1
            26   11  13 1
            27   13  20 1 #Down
            28   15  16 1
            29   17  19 1
            30   10  26 1
            31   26  27 1
            32   27  28 2
            33   28  29 1
            34   29  30 2
            35   30  31 1
            36   31  32 2
            37   27  32 1
            38   15  33 1
            39   33  34 1
            40   34  35 1
            41   35  36 1
            42   36  37 1
            43   37  38 2
            44   38  39 1
            45   39  40 2
            46   40  41 1
            47   41  42 2
            48   37  42 1
            49   35  43 2
            50   40  44 1

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