KEGG   COMPOUND: C09512
Entry
C09512                      Compound                               
Name
Molephantin
Formula
C19H22O6
Exact mass
346.1416
Mol weight
346.3744
Structure
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Germacrenes
    C09512  Molephantin
Other DBs
CAS: 50656-66-1
PubChem: 11703
ChEBI: 6962
KNApSAcK: C00003333
3DMET: B03035
NIKKAJI: J9.746B
LinkDB
KCF data

ATOM        25
            1   C1y C    25.2618  -16.1966
            2   C1y C    23.9366  -16.5532
            3   C1y C    25.9798  -15.0176
            4   C2y C    26.0148  -17.3532
            5   C1y C    22.1788  -15.9814
            6   O7x O    23.9364  -17.9253
            7   C1x C    25.9856  -13.6400
            8   C7x C    25.1505  -18.4152
            9   C2a C    27.3925  -17.3534
            10  C2y C    24.7891  -12.9394
            11  O6a O    25.5131  -19.7462
            12  C1a C    19.9308  -15.5253
            13  C2x C    23.5916  -13.6283
            14  C1a C    24.7951  -11.5618
            15  C5x C    22.4069  -12.9335
            16  O7a O    27.2765  -15.5416
            17  C7a C    28.4895  -14.6901
            18  C2c C    29.6814  -15.3732
            19  O6a O    28.4837  -13.3067
            20  C1a C    30.8780  -14.6791
            21  C2a C    29.6831  -16.7581
            22  C2y C    21.2148  -15.0052
            23  C2x C    21.2104  -13.6340
            24  O1a O    21.4524  -17.1587
            25  O5x O    22.4074  -11.5486
BOND        26
            1     8  11 2
            2    22  12 1
            3    10  13 2
            4    10  14 1
            5    23  15 1
            6     6   8 1
            7    13  15 1
            8     3  16 1 #Down
            9     1   2 1
            10    1   3 1
            11    1   4 1
            12   16  17 1
            13   17  18 1
            14   17  19 2
            15    2   5 1
            16   18  20 1
            17    2   6 1
            18   18  21 2
            19    3   7 1
            20    5  22 1
            21    4   8 1
            22   22  23 2
            23    4   9 2
            24    5  24 1 #Up
            25    7  10 1
            26   15  25 2

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