KEGG   COMPOUND: C09437
Entry
C09437                      Compound                               
Name
Eupatocunin
Formula
C22H28O7
Exact mass
404.1835
Mol weight
404.4535
Structure
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Germacrenes
    C09437  Eupatocunin
Other DBs
CAS: 33853-87-1
PubChem: 11628
ChEBI: 4933
KNApSAcK: C00003275
3DMET: B05353
NIKKAJI: J19.846C
LinkDB
KCF data

ATOM        29
            1   C1y C    23.9685  -15.9740
            2   C2x C    22.6096  -15.6286
            3   C1y C    25.3332  -15.6054
            4   O7x O    23.9682  -17.3984
            5   C2y C    21.6138  -14.6281
            6   C1y C    26.4225  -14.6164
            7   C2y C    26.1114  -16.7887
            8   C7x C    25.2220  -17.8957
            9   C1y C    21.6196  -13.2168
            10  C1y C    26.3583  -13.2051
            11  O7a O    27.7051  -15.1065
            12  C2a C    27.3827  -16.7947
            13  O6a O    25.5906  -19.2602
            14  C1x C    22.8495  -12.5134
            15  C2y C    25.2106  -12.4958
            16  C7a C    28.9295  -14.4043
            17  C2x C    23.9977  -13.1981
            18  C2c C    30.1536  -15.1065
            19  O6a O    28.9295  -13.2030
            20  C1a C    31.3719  -14.4043
            21  C1a C    20.3106  -15.2974
            22  O7a O    20.4036  -12.5036
            23  C7a C    19.1806  -13.2044
            24  C1a C    17.9717  -12.4912
            25  O6a O    19.1735  -14.3315
            26  C2b C    30.1550  -16.5136
            27  C1a C    25.2045  -11.0909
            28  C1a C    28.9432  -17.2148
            29  O1a O    27.7224  -12.3858
BOND        30
            1     6  10 1
            2     6  11 1 #Up
            3     7  12 2
            4     8  13 2
            5    14   9 1
            6    10  15 1
            7    11  16 1
            8    14  17 1
            9    16  18 1
            10   16  19 2
            11   18  20 1
            12    7   8 1
            13   15  17 2
            14    5  21 1
            15    1   2 1
            16    9  22 1 #Up
            17    1   3 1
            18   22  23 1
            19    1   4 1
            20   23  24 1
            21    2   5 2
            22   23  25 2
            23    3   6 1
            24   18  26 2
            25    3   7 1
            26    4   8 1
            27   15  27 1
            28   26  28 1
            29    5   9 1
            30   10  29 1

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