KEGG   COMPOUND: C20193
Entry
C20193                      Compound                               
Name
beta-seco-Amyrin;
8,14-Secooleana-7,13-diene-3beta-ol
Formula
C30H50O
Exact mass
426.3862
Mol weight
426.72
Structure
Reaction
R09914
Pathway
map00909  Sesquiterpenoid and triterpenoid biosynthesis
Enzyme
5.4.99.54
Other DBs
PubChem: 163311936
LinkDB
KCF data

ATOM        31
            1   C2y C    19.1914  -17.8346
            2   C2y C    20.4567  -16.4572
            3   C1y C    18.0006  -17.1328
            4   C2x C    19.1914  -19.2150
            5   C2y C    20.4050  -15.0825
            6   C1x C    21.5726  -17.1590
            7   C1z C    16.8101  -17.8231
            8   C1b C    18.0122  -15.0596
            9   C1x C    17.9892  -19.8995
            10  C1y C    21.6071  -14.4097
            11  C1b C    19.2144  -14.3867
            12  C1x C    22.8444  -16.4859
            13  C1y C    16.8042  -19.2035
            14  C1x C    15.6137  -17.1271
            15  C1a C    16.7928  -16.4369
            16  C1z C    22.7860  -15.1114
            17  C1x C    21.6244  -13.0350
            18  C1z C    15.6137  -19.8937
            19  C1x C    14.4116  -17.8231
            20  C1x C    23.9873  -14.4442
            21  C1a C    23.9767  -15.8016
            22  C1z C    22.8264  -12.3620
            23  C1y C    14.4116  -19.2035
            24  C1a C    16.0967  -21.3660
            25  C1a C    14.9063  -21.0901
            26  C1x C    24.0056  -13.0694
            27  O1a O    13.2096  -19.8880
            28  C1a C    19.0709  -16.4572
            29  C1a C    20.5771  -17.8346
            30  C1a C    23.5264  -11.1496
            31  C1a C    22.1264  -11.1496
BOND        34
            1     1   3 1
            2     1   4 2
            3     2   5 2
            4     2   6 1
            5     3   7 1
            6     3   8 1
            7     4   9 1
            8     5  10 1
            9     5  11 1
            10    6  12 1
            11    7  13 1
            12    7  14 1
            13    7  15 1 #Up
            14   10  16 1
            15   10  17 1
            16   13  18 1
            17   14  19 1
            18   16  20 1
            19   16  21 1 #Up
            20   17  22 1
            21   18  23 1
            22   18  24 1
            23   18  25 1
            24   20  26 1
            25   23  27 1 #Up
            26    8  11 1
            27    9  13 1
            28   12  16 1
            29   19  23 1
            30   22  26 1
            31    2  28 1
            32    1  29 1
            33   22  30 1
            34   22  31 1

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