KEGG   COMPOUND: C22437
Entry
C22437                      Compound                               
Name
11-Carbonyl-2beta,20beta-dihydroxycucurbitadienol
Formula
C30H48O4
Exact mass
472.3553
Mol weight
472.70
Structure
Reaction
Pathway
map00996  Biosynthesis of various alkaloids
map01110  Biosynthesis of secondary metabolites
Enzyme
1.14.14.-
Brite
Lipids [BR:br08002]
 ST  Sterol lipids
  ST01 Sterols
   ST0101 Cholesterol and derivatives
    C22437  11-Carbonyl-2beta,20beta-dihydroxycucurbitadienol
Other DBs
PubChem: 497619796
LinkDB
KCF data

ATOM        34
            1   C1y C    12.7716  -17.4023
            2   C1y C    12.7716  -18.8059
            3   C1z C    13.9645  -19.5076
            4   C2y C    15.1574  -18.8059
            5   C1y C    15.1574  -17.4023
            6   C1x C    13.9645  -16.7006
            7   C2x C    16.3504  -19.5076
            8   C1x C    17.5434  -18.8059
            9   C1y C    17.5434  -17.4023
            10  C1z C    16.3504  -16.7006
            11  C1z C    18.7363  -16.7006
            12  C1z C    18.7363  -15.3673
            13  C1x C    17.5434  -14.6656
            14  C5x C    16.3504  -15.3673
            15  C1y C    19.9293  -14.6656
            16  C1x C    21.1222  -15.3673
            17  C1d C    19.9293  -13.3322
            18  C1b C    21.1222  -12.6305
            19  C1b C    22.2450  -13.2621
            20  C2b C    23.4380  -12.6305
            21  C2c C    24.5608  -13.2621
            22  C1a C    25.7537  -12.6305
            23  C1a C    24.5608  -14.6656
            24  C1x C    21.1222  -16.7006
            25  C1a C    12.9821  -20.4199
            26  C1a C    14.9469  -20.4199
            27  C1a C    18.7363  -12.6305
            28  C1a C    18.7363  -18.1041
            29  O1a O    11.5785  -19.5076
            30  C1a C    15.8594  -17.9636
            31  C1a C    18.7363  -13.9638
            32  O5x O    15.1340  -14.6650
            33  O1a O    19.9293  -11.9322
            34  O1a O    11.5451  -16.7004
BOND        37
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 2
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    9  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   10  14 1
            17   12  15 1
            18   15  16 1
            19   15  17 1
            20   17  18 1
            21   18  19 1
            22   19  20 1
            23   20  21 2
            24   21  22 1
            25   21  23 1
            26   16  24 1
            27   24  11 1
            28    3  25 1
            29    3  26 1
            30   17  27 1 #Down
            31   11  28 1 #Down
            32    2  29 1 #Up
            33   10  30 1 #Up
            34   12  31 1 #Up
            35   14  32 2
            36   17  33 1 #Up
            37    1  34 1 #Up

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