KEGG   COMPOUND: C09429Help
Entry
C09429                      Compound                               

Name
Eupacunoxin
Formula
C22H28O8
Exact mass
420.1784
Mol weight
420.4529
Structure
Mol fileKCF fileDB search
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Germacrenes
    C09429  Eupacunoxin
BRITE hierarchy
Other DBs
CAS: 33853-88-2
PubChem: 11620
ChEBI: 4925
ChEMBL: CHEMBL484877
KNApSAcK: C00003268
3DMET: B02959
NIKKAJI: J18.795J
KCF data Show

ATOM        30
            1   O7a O    20.0910  -11.2845
            2   C1y C    23.9809  -16.0965
            3   C1y C    25.1970  -15.3796
            4   C1y C    22.5914  -16.1053
            5   C2y C    24.4239  -17.4157
            6   O7a O    26.4841  -16.1236
            7   C2x C    25.5213  -14.0239
            8   C2x C    21.3707  -15.4211
            9   O7x O    22.1722  -17.4392
            10  C7x C    23.3029  -18.2387
            11  C2a C    25.7547  -17.8232
            12  C2y C    25.1462  -12.6816
            13  C2y C    20.9977  -14.0706
            14  O6a O    23.3177  -19.6383
            15  C1y C    23.9112  -12.0151
            16  C1a C    26.2260  -11.8135
            17  C1y C    21.3179  -12.7650
            18  C1a C    19.6041  -14.0957
            19  C1x C    22.5188  -12.0530
            20  O1a O    24.2426  -10.6596
            21  C7a C    27.5954  -15.4170
            22  C1z C    28.8008  -16.1243
            23  O6a O    27.5969  -14.0239
            24  C1y C    30.2008  -16.1258
            25  O2x O    29.5036  -14.9188
            26  C1a C    28.8005  -17.5229
            27  C1a C    31.4078  -15.4157
            28  C7a C    18.7372  -11.6464
            29  C1a C    17.7469  -10.6542
            30  O6a O    18.3315  -12.9187
BOND        32
            1     4   8 1
            2     4   9 1
            3     5  10 1
            4     5  11 2
            5     7  12 2
            6     8  13 2
            7    10  14 2
            8    12  15 1
            9    12  16 1
            10   13  17 1
            11   13  18 1
            12   15  19 1
            13   15  20 1 #Down
            14   17   1 1 #Up
            15    9  10 1
            16   17  19 1
            17    2   3 1
            18    2   4 1
            19    2   5 1
            20    6  21 1
            21   22  21 1 #Down
            22   21  23 2
            23   22  24 1
            24   22  25 1
            25   22  26 1 #Up
            26   24  27 1 #Down
            27   24  25 1
            28    1  28 1
            29    3   6 1 #Up
            30   28  29 1
            31    3   7 1
            32   28  30 2

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