KEGG   COMPOUND: C19735
Entry
C19735                      Compound                               
Name
(-)-endo-alpha-Bergamotene
Formula
C15H24
Exact mass
204.1878
Mol weight
204.35
Structure
Reaction
Enzyme
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Bisabolanes
    C19735  (-)-endo-alpha-Bergamotene
Other DBs
PubChem: 135626202
KNApSAcK: C00029970
LinkDB
KCF data

ATOM        15
            1   C1y C    23.7300  -14.4200
            2   C1z C    23.7300  -15.8200
            3   C1y C    24.9424  -16.5200
            4   C1x C    26.1549  -15.8200
            5   C2x C    26.1549  -14.4200
            6   C2y C    24.9424  -13.7200
            7   C1b C    22.5176  -16.5200
            8   C1b C    21.3221  -15.8296
            9   C2b C    20.1347  -16.5151
            10  C2c C    18.9435  -15.8271
            11  C1a C    17.7540  -16.5138
            12  C1a C    18.9435  -14.4203
            13  C1a C    24.9424  -12.3202
            14  C1a C    22.5176  -15.1200
            15  C1x C    24.9424  -15.1200
BOND        16
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     2   7 1 #Down
            8     7   8 1
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12   10  12 1
            13    6  13 1
            14    2  14 1 #Up
            15    1  15 1 #Up
            16    3  15 1 #Up

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