KEGG   COMPOUND: C08789
Entry
C08789                      Compound                               
Name
Bryodulcosigenin
Formula
C30H50O4
Exact mass
474.3709
Mol weight
474.7156
Structure
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Triterpenoids (C30)
   Others
    C08789  Bryodulcosigenin
Other DBs
CAS: 4965-97-3
PubChem: 10982
ChEBI: 3198
KNApSAcK: C00003678
3DMET: B05291
NIKKAJI: J40.040H
LinkDB
KCF data

ATOM        34
            1   C1y C    24.3239  -30.8951
            2   C1z C    25.5096  -30.2175
            3   C1z C    23.1382  -30.2059
            4   C1x C    24.3239  -32.2735
            5   C1z C    25.4572  -28.8508
            6   C1x C    27.8810  -30.2467
            7   C1a C    25.4979  -31.5901
            8   C1y C    21.8768  -30.8834
            9   C5x C    23.1499  -28.8333
            10  C1a C    23.7565  -31.5784
            11  C2x C    23.1265  -32.9568
            12  C1y C    26.7246  -28.1792
            13  C1x C    24.3473  -28.1499
            14  C1a C    25.4455  -27.4782
            15  C1x C    27.8286  -28.8799
            16  C2y C    21.9408  -32.2618
            17  C1x C    20.7551  -30.2001
            18  O5x O    21.9642  -28.1324
            19  C1c C    26.7187  -26.8065
            20  C1z C    20.7551  -32.9511
            21  C1x C    19.5637  -30.8834
            22  C1b C    27.8986  -26.1232
            23  C1a C    25.5155  -26.1232
            24  C1y C    19.5637  -32.2618
            25  C1a C    21.4327  -34.1368
            26  C1a C    20.0542  -34.1368
            27  C1b C    29.0900  -26.8007
            28  O1a O    18.3663  -32.9451
            29  C1c C    30.2757  -26.1115
            30  C1d C    31.4614  -26.7890
            31  O1a O    30.3400  -24.7388
            32  C1a C    32.6531  -26.0998
            33  C1a C    32.6531  -27.4840
            34  O1a O    31.4557  -28.1675
BOND        37
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     2   7 1 #Down
            7     3   8 1
            8     3   9 1
            9     3  10 1 #Up
            10    4  11 1
            11    5  12 1
            12    5  13 1
            13    5  14 1 #Up
            14    6  15 1
            15    8  16 1
            16    8  17 1
            17    9  18 2
            18   12  19 1
            19   16  20 1
            20   17  21 1
            21   19  22 1
            22   19  23 1 #Down
            23   20  24 1
            24   20  25 1
            25   20  26 1
            26   22  27 1
            27   24  28 1 #Up
            28   27  29 1
            29   29  30 1
            30   29  31 1
            31   30  32 1
            32   30  33 1
            33   30  34 1
            34    9  13 1
            35   11  16 2
            36   12  15 1
            37   21  24 1

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