KEGG   DRUG: Siccanin
Entry
D01257                      Drug                                   
Name
Siccanin (JAN/INN);
Siccanin (TN)
Formula
C22H30O3
Exact mass
342.2195
Mol weight
342.47
Structure
Source
Helminthosporium siccans
Efficacy
Antifungal
Comment
natural product
Brite
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Inorganic and organic chemicals
   Siccanin
    D01257  Siccanin (JAN/INN)
Other DBs
CAS: 22733-60-4
PubChem: 7848320
LigandBox: D01257
NIKKAJI: J11.482K
LinkDB
KCF data

ATOM        25
            1   C8x C    27.8848  -17.2542
            2   C8y C    27.8909  -15.8630
            3   C8x C    26.6864  -15.1619
            4   C8y C    26.6739  -17.9444
            5   C8y C    25.4764  -17.2434
            6   C8y C    25.4886  -15.8523
            7   O2x O    24.2898  -15.1461
            8   C1y C    24.2655  -17.9285
            9   C1y C    23.0668  -17.2223
            10  C1z C    23.0855  -15.8348
            11  C1x C    21.8933  -15.1248
            12  C1x C    20.6824  -15.8024
            13  C1z C    21.8559  -17.8999
            14  C1y C    20.6702  -17.1871
            15  C1z C    19.4603  -17.8575
            16  C1x C    19.4358  -19.2405
            17  C1x C    21.8313  -19.2830
            18  C1x C    22.2196  -19.2525
            19  O2x O    23.9058  -19.2811
            20  C1a C    23.1053  -14.4503
            21  O1a O    26.6660  -19.3356
            22  C1a C    29.0985  -15.1721
            23  C1x C    20.6281  -19.9574
            24  C1a C    19.0879  -16.5043
            25  C1a C    18.1041  -18.2117
BOND        29
            1    12  14 1
            2    13   9 1
            3     2   3 1
            4     3   6 2
            5     5   6 1
            6     6   7 1
            7     7  10 1
            8    13  14 1
            9    14  15 1
            10   15  16 1
            11   17  13 1
            12    9   8 1
            13   13  18 1
            14    8   5 1
            15    8  19 1
            16   19  18 1
            17    5   4 2
            18   10  20 1
            19    4   1 1
            20    4  21 1
            21    2  22 1
            22    1   2 2
            23   17  23 1
            24    9  10 1
            25   16  23 1
            26   10  11 1
            27   15  24 1
            28   11  12 1
            29   15  25 1

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