KEGG   DRUG: Tigilanol tiglate
Entry
D11191                      Drug                                   
Name
Tigilanol tiglate (USAN/INN)
Formula
C30H42O10
Exact mass
562.2778
Mol weight
562.6485
Structure
Source
Hylandia dockrillii [TAX:316767]
Efficacy
Antineoplastic, Protein kinase C activator
Target
PRKCB [HSA:5579] [KO:K19662]
PRKCA [HSA:5578] [KO:K02677]
PRKCG [HSA:5582] [KO:K19663]
Brite
Target-based classification of drugs [BR:br08310]
 Protein kinases
  Serine/threonine kinases
   AGC group
    PRKCA
     D11191  Tigilanol tiglate (USAN/INN)
    PRKCB
     D11191  Tigilanol tiglate (USAN/INN)
    PRKCG
     D11191  Tigilanol tiglate (USAN/INN)
Other DBs
CAS: 943001-56-7
PubChem: 384585170
ChEBI: 194146
KCF data

ATOM        40
            1   C1y C    20.1047  -14.4090
            2   C1y C    21.2017  -13.5450
            3   C1z C    22.5675  -13.8565
            4   C1y C    23.1695  -15.1100
            5   C1z C    20.1047  -15.8183
            6   C1z C    22.5684  -16.3777
            7   C1y C    21.2017  -16.6894
            8   C2x C    21.0758  -18.0856
            9   C2y C    22.3647  -18.6367
            10  C5x C    23.2872  -17.5811
            11  C1y C    18.8920  -13.7088
            12  C1z C    17.6791  -14.4090
            13  C1y C    17.6791  -15.8183
            14  C1y C    18.8920  -16.5185
            15  C1a C    22.6718  -19.9848
            16  O5x O    24.7094  -17.7096
            17  O1a O    23.9687  -16.3777
            18  O1a O    24.5758  -15.1065
            19  O2x O    22.1919  -12.5547
            20  C1b C    23.8541  -13.3659
            21  O1a O    25.0975  -14.0534
            22  O1a O    20.1047  -17.2187
            23  C1a C    18.8919  -17.9251
            24  O7a O    16.4902  -16.5052
            25  C7a C    16.4902  -17.9056
            26  C2c C    15.2947  -18.5964
            27  O6a O    17.7367  -18.6250
            28  C1a C    14.0714  -17.8903
            29  C2b C    15.2256  -20.0254
            30  C1a C    14.0591  -20.7406
            31  C1z C    17.6791  -13.0086
            32  C1a C    16.6889  -12.0183
            33  C1a C    17.6791  -11.6082
            34  O7a O    16.3137  -14.4094
            35  C7a C    14.9134  -14.4094
            36  O6a O    14.2196  -13.2077
            37  C1c C    14.2067  -15.6333
            38  C1b C    12.8063  -15.6333
            39  C1a C    14.9004  -16.8347
            40  C1a C    12.1158  -16.8292
BOND        44
            1     3   4 1
            2     1   5 1
            3     4   6 1
            4     2   3 1
            5     5   7 1
            6     1   2 1
            7     6   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11    6  10 1
            12    1  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16    5  14 1
            17    9  15 1
            18   10  16 2
            19    6  17 1 #Up
            20    4  18 1 #Up
            21    2  19 1
            22    3  19 1
            23    3  20 1 #Up
            24   20  21 1
            25    5  22 1 #Down
            26   14  23 1 #Down
            27   13  24 1 #Up
            28   24  25 1
            29   25  26 1
            30   25  27 2
            31   26  28 1
            32   26  29 2
            33   29  30 1
            34   11  31 1
            35   12  31 1
            36   31  32 1
            37   31  33 1
            38   12  34 1 #Down
            39   34  35 1
            40   35  36 2
            41   35  37 1
            42   37  38 1
            43   37  39 1 #Up
            44   38  40 1

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Ontology (1)   
   KEGG BRITE (1)   
Chemical substance (2)   
   PubChem (1)   
   ChEBI (1)   
Gene (6)   
   KEGG ORTHOLOGY (3)   
   KEGG GENES (3)   
All databases (9)   

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