KEGG   COMPOUND: C20834
Entry
C20834                      Compound                               

Name
Cyclooctat-9-en-7-ol;
(1S,3aS,4R,7S,9aS,10aS)-1,4,9a-Trimethyl-7-(propan-2-yl)-1,2,3,3a,4,5,7,8,9,9a,10,10a-dodecahydrodicyclopenta[a,d][8]annulen-4-ol
Formula
C20H34O
Exact mass
290.261
Mol weight
290.4834
Structure
Reaction
Pathway
map00999  Biosynthesis of various secondary metabolites - part 1
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00921  Cyclooctatin biosynthesis, dimethylallyl-PP + isopentenyl-PP => cyclooctatin
Enzyme
1.14.99.61      4.2.3.146
Other DBs
PubChem: 254741300
KCF data

ATOM        21
            1   C1y C    16.1266  -16.5539
            2   C1x C    14.9118  -17.2553
            3   C1x C    15.2033  -18.6274
            4   C1y C    16.5985  -18.7741
            5   C1y C    17.1691  -17.4925
            6   C1z C    16.1266  -15.1511
            7   C1x C    17.1185  -14.1592
            8   C2x C    18.5213  -14.1592
            9   C2y C    19.5132  -15.1511
            10  C1z C    19.5132  -16.5539
            11  C1x C    18.5719  -17.4925
            12  C1x C    20.8474  -16.9873
            13  C1x C    21.6719  -15.8525
            14  C1y C    20.8474  -14.7176
            15  C1c C    21.2749  -13.4012
            16  C1a C    22.6207  -13.1147
            17  C1a C    20.3220  -12.3429
            18  C1a C    17.3151  -20.0155
            19  C1a C    19.5132  -17.9567
            20  C1a C    14.7994  -14.6019
            21  O1a O    16.1266  -13.7511
BOND        23
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     1   5 1
            6     1   6 1
            7     6   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11    5  11 1
            12   11  10 1
            13   10  12 1
            14   12  13 1
            15   13  14 1
            16    9  14 1
            17   14  15 1 #Down
            18   15  16 1
            19   15  17 1
            20    4  18 1 #Up
            21   10  19 1 #Down
            22    6  20 1 #Up
            23    6  21 1 #Down

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