KEGG   COMPOUND: C19678Help
Entry
C19678                      Compound                               

Name
Germacrene A acid;
Germacra-1(10),4,11(13)-trien-12-oate
Formula
C15H22O2
Exact mass
234.162
Mol weight
234.334
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Sesquiterpenoid and triterpenoid biosynthesis
Biosynthesis of secondary metabolites
Enzyme
1.1.1.314       1.14.13.120
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Germacrenes
    C19678  Germacrene A acid
BRITE hierarchy
Other DBs
PubChem: 
KNApSAcK: 
KCF data Show

ATOM        17
            1   C2x C    26.4791   -9.9396
            2   C2y C    27.5765   -9.0755
            3   C1x C    28.9426   -9.3871
            4   C1x C    29.5449  -10.6410
            5   C2x C    26.4791  -11.3495
            6   C1y C    28.9435  -11.9089
            7   C1x C    27.5765  -12.2209
            8   C1x C    25.1385   -9.5040
            9   C1x C    24.3097  -10.6445
            10  C2y C    25.1385  -11.7851
            11  C1a C    24.7082  -13.1090
            12  C1a C    27.2624   -7.6824
            13  C2c C    29.7957  -12.9707
            14  C6a C    29.2805  -14.2964
            15  C2a C    31.2062  -12.7538
            16  O6a O    27.8795  -14.5126
            17  O6a O    30.1410  -15.3680
BOND        17
            1     3   4 1
            2     4   6 1
            3     2   3 1
            4     5   7 1
            5     1   2 2
            6     6   7 1
            7     1   8 1
            8     8   9 1
            9     9  10 1
            10    5  10 2
            11   10  11 1
            12    2  12 1
            13    6  13 1 #Up
            14   13  14 1
            15   13  15 2
            16   14  16 2
            17   14  17 1

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