KEGG   COMPOUND: C17156
Entry
C17156                      Compound                               
Name
Manoalide
Formula
C25H36O5
Exact mass
416.2563
Mol weight
416.5503
Structure
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR01 Isoprenoids
   PR0105 C25 isoprenoids (sesterterpenes)
    PR010502 Cyclohexane sesterterpenoids
     C17156  Manoalide
Other DBs
CAS: 75088-80-1
PubChem: 135626091
ChEBI: 66666
LIPIDMAPS: LMPR0105020001
KNApSAcK: C00039732
KCF data

ATOM        30
            1   C2y C    34.6457  -21.0673
            2   C2y C    34.6457  -22.4671
            3   C1x C    35.8579  -23.1670
            4   C1x C    37.0702  -22.4671
            5   C1x C    37.0702  -21.0673
            6   C1z C    35.8579  -20.3674
            7   C1b C    33.4335  -20.3674
            8   C1b C    32.2211  -21.0673
            9   C2c C    31.0089  -20.3674
            10  C2b C    29.7967  -21.0673
            11  C1b C    28.5844  -20.3674
            12  C1b C    27.3722  -21.0673
            13  C2y C    26.1600  -20.3674
            14  C1a C    33.4335  -23.1670
            15  C1a C    36.5578  -19.1552
            16  C1a C    34.8681  -19.3777
            17  C1a C    31.0089  -18.9677
            18  C2x C    26.1600  -18.9678
            19  C1x C    24.9477  -18.2679
            20  C1y C    23.7355  -18.9678
            21  O2x O    23.7355  -20.3674
            22  C1y C    24.9477  -21.0673
            23  C2y C    22.5172  -18.2644
            24  C1y C    22.3715  -16.8779
            25  O7x O    21.0080  -16.5879
            26  C7x C    20.3108  -17.7951
            27  C2x C    21.2435  -18.8313
            28  O1a O    23.4311  -15.9238
            29  O6a O    18.9079  -17.8027
            30  O1a O    24.9477  -22.4668
BOND        32
            1     1   2 2
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     1   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14    2  14 1
            15    6  15 1
            16    6  16 1
            17    9  17 1
            18   13  18 2
            19   18  19 1
            20   19  20 1
            21   20  21 1
            22   21  22 1
            23   13  22 1
            24   20  23 1 #Up
            25   23  24 1
            26   24  25 1
            27   25  26 1
            28   26  27 1
            29   23  27 2
            30   24  28 1 #Up
            31   26  29 2
            32   22  30 1 #Down

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