KEGG   COMPOUND: C09172
Entry
C09172                      Compound                               
Name
Podolactone B
Formula
C19H22O9
Exact mass
394.1264
Mol weight
394.3726
Structure
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Diterpenoids (C20)
   Others
    C09172  Podolactone B
Other DBs
CAS: 26804-82-0
PubChem: 11364
ChEBI: 8278
KNApSAcK: C00000264
3DMET: B02740
NIKKAJI: J148.695K
LinkDB
KCF data

ATOM        28
            1   C1z C    26.1043  -15.4162
            2   C1y C    26.1043  -16.7989
            3   C2y C    24.9087  -14.7135
            4   O2x O    27.2997  -16.1017
            5   C1y C    27.3112  -14.7369
            6   C1y C    24.9087  -17.4784
            7   C1z C    23.7147  -15.4045
            8   C2x C    24.9204  -13.3366
            9   O7x O    27.3229  -13.3542
            10  C1y C    23.7206  -16.7872
            11  C1y C    22.5133  -14.7135
            12  C1a C    23.6960  -14.0163
            13  C7x C    26.1277  -12.6513
            14  C1z C    22.5133  -17.4784
            15  C1y C    21.3181  -15.4045
            16  O2x O    21.3821  -14.0863
            17  O6a O    26.1394  -11.2629
            18  C1y C    21.3181  -16.7872
            19  C1a C    21.3064  -18.1567
            20  O1a O    19.9239  -16.7872
            21  O7x O    24.5356  -18.8285
            22  C7x C    22.8679  -18.8285
            23  O6a O    22.0071  -19.9511
            24  C1d C    28.5209  -15.4368
            25  C1b C    29.7433  -14.7303
            26  O1a O    30.9656  -15.4298
            27  O1a O    28.5138  -17.2701
            28  C1a C    29.7433  -16.1434
BOND        33
            1     6  10 1
            2     7  11 1
            3     7  12 1 #Up
            4     8  13 1
            5    10  14 1
            6    11  15 1
            7    11  16 1
            8    13  17 2
            9    14  18 1
            10   14  19 1 #Down
            11   18  20 1 #Up
            12    2   4 1 #Down
            13    7  10 1
            14    9  13 1
            15   15  16 1
            16   15  18 1
            17    6  21 1
            18    1   2 1
            19   14  22 1
            20   22  21 1
            21    1   3 1
            22   22  23 2
            23    1   4 1 #Down
            24    1   5 1
            25    5  24 1
            26    2   6 1
            27   24  25 1
            28    3   7 1
            29   25  26 1
            30    3   8 2
            31   24  27 1 #Up
            32    5   9 1
            33   24  28 1 #Down

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