KEGG   COMPOUND: C09440
Entry
C09440                      Compound                               

Name
Eupatolide
Formula
C15H20O3
Exact mass
248.1412
Mol weight
248.3175
Structure
Reaction
Enzyme
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Germacrenes
    C09440  Eupatolide
Other DBs
CAS: 6750-25-0
PubChem: 11631
ChEBI: 4935
ChEMBL: CHEMBL485296
KNApSAcK: C00003277
3DMET: B02968
NIKKAJI: J20.676H
KCF data

ATOM        18
            1   C1y C    18.3147  -16.6466
            2   C1y C    19.7277  -16.5988
            3   O7x O    17.9194  -18.0068
            4   C2x C    17.3999  -15.7022
            5   C2y C    20.2079  -17.9301
            6   C1y C    20.5782  -15.4701
            7   C7x C    19.0897  -18.7962
            8   C2y C    16.0074  -15.7141
            9   C2a C    21.5547  -18.3258
            10  C1x C    20.2279  -14.1030
            11  O1a O    21.9752  -15.4621
            12  O6a O    19.0613  -20.2074
            13  C1x C    15.4275  -14.4403
            14  C1a C    15.3212  -16.9266
            15  C2y C    18.9411  -13.5337
            16  C1x C    16.4670  -13.4883
            17  C2x C    17.6844  -14.1141
            18  C1a C    18.9017  -12.1321
BOND        19
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     4   8 2
            8     5   9 2
            9     6  10 1
            10    6  11 1 #Up
            11    7  12 2
            12    8  13 1
            13    8  14 1
            14   10  15 1
            15   13  16 1
            16   15  17 2
            17   15  18 1
            18    5   7 1
            19   16  17 1

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