KEGG   COMPOUND: C20477
Entry
C20477                      Compound                               
Name
(-)-alpha-Isocomene;
(1R,3aS,5aS,8aR)-1,3a,4,5a-Tetramethyl-1,2,3,3a,5a,6,7,8-octahydrocyclopenta[c]pentalene
Formula
C15H24
Exact mass
204.1878
Mol weight
204.35
Structure
Reaction
R10272
Enzyme
4.2.3.136
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR01 Isoprenoids
   PR0103 C15 isoprenoids (sesquiterpenes)
    PR010376 Isocomane sesquiterpenoids
     C20477  (-)-alpha-Isocomene
Other DBs
PubChem: 163312214
LinkDB
KCF data

ATOM        15
            1   C1z C    18.4867  -15.7581
            2   C1z C    18.4867  -17.1589
            3   C2y C    19.8189  -17.5917
            4   C2x C    20.6422  -16.4585
            5   C1z C    19.8189  -15.3253
            6   C1y C    17.1545  -15.3253
            7   C1x C    16.3312  -16.4585
            8   C1x C    17.1545  -17.5917
            9   C1x C    19.8189  -13.9246
            10  C1x C    18.4867  -13.4917
            11  C1x C    17.6634  -14.6249
            12  C1a C    21.0319  -14.6249
            13  C1a C    20.2479  -18.9120
            14  C1a C    18.4867  -18.5596
            15  C1a C    16.4542  -14.1122
BOND        17
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     1   5 1
            6     1   6 1
            7     6   7 1
            8     7   8 1
            9     2   8 1
            10    5   9 1
            11    9  10 1
            12   10  11 1
            13    1  11 1 #Up
            14    5  12 1 #Down
            15    3  13 1
            16    2  14 1 #Up
            17    6  15 1 #Up

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