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   C1x C    21.9800  -22.6100
            2   C1x C    21.9800  -24.0100
            3   C2y C    23.2400  -24.7100
            4   C2x C    24.4300  -24.0100
            5   C2y C    24.4300  -22.6100
            6   C2x C    23.2400  -21.9100
            7   C1x C    25.6200  -24.7100
            8   C1y C    26.8100  -24.0100
            9   C1x C    26.8100  -22.6100
            10  C1x C    25.6200  -21.9100
            11  C1a C    24.4300  -21.2100
            12  C1a C    23.2400  -26.1100
            13  C2c C    28.0000  -24.7100
            14  C6a C    29.1900  -24.0100
            15  C2a C    28.0000  -26.1100
            16  O6a O    30.3800  -24.7100
            17  O6a O    29.1900  -22.6100
BOND        17
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     5   6 2
            5     1   6 1
            6     4   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10    5  10 1
            11    5  11 1
            12    3  12 1
            13    8  13 1 #Up
            14   13  14 1
            15   13  15 2
            16   14  16 1
            17   14  17 2

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