KEGG   COMPOUND: C19660
Entry
C19660                      Compound                               
Name
Bufanolide
Formula
C24H38O2
Exact mass
358.2872
Mol weight
358.5573
Structure
Comment
Generic compound
Other DBs
PubChem: 135626128
KCF data

ATOM        26
            1   C1x C    10.7800  -24.4300
            2   C1x C    10.7800  -25.8300
            3   C1x C    11.9924  -26.5300
            4   C1y C    13.2049  -25.8300
            5   C1z C    13.2049  -24.4300
            6   C1x C    11.9924  -23.7300
            7   C1x C    14.4173  -26.5300
            8   C1x C    15.6297  -25.8300
            9   C1y C    15.6297  -24.4300
            10  C1y C    14.4173  -23.7300
            11  C1y C    16.8422  -23.7300
            12  C1z C    16.8422  -22.3300
            13  C1x C    15.6297  -21.6300
            14  C1x C    14.4173  -22.3300
            15  C1x C    19.2670  -23.7300
            16  C1x C    19.2670  -22.3300
            17  C1y C    18.0546  -21.6300
            18  C1y C    18.0546  -20.2300
            19  C1x C    19.2711  -19.5277
            20  C1x C    19.2711  -18.1277
            21  C7x C    18.0586  -17.4277
            22  O7x O    16.8422  -18.1300
            23  C1x C    16.8422  -19.5300
            24  O6a O    18.0586  -16.0300
            25  C1a C    16.8422  -20.9300
            26  C1a C    13.2049  -23.0300
BOND        30
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    9  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   10  14 1
            17   11  15 1
            18   15  16 1
            19   16  17 1
            20   12  17 1
            21   17  18 1
            22   18  19 1
            23   19  20 1
            24   20  21 1
            25   21  22 1
            26   22  23 1
            27   18  23 1
            28   21  24 2
            29   12  25 1 #Up
            30    5  26 1 #Up

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