KEGG   COMPOUND: C16028
Entry
C16028                      Compound                               
Name
Amorpha-4,11-diene
Formula
C15H24
Exact mass
204.1878
Mol weight
204.3511
Structure
Reaction
Pathway
map00909  Sesquiterpenoid and triterpenoid biosynthesis
map01110  Biosynthesis of secondary metabolites
Enzyme
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR01 Isoprenoids
   PR0103 C15 isoprenoids (sesquiterpenes)
    PR010333 Cadinane sesquiterpenoids
     C16028  Amorpha-4,11-diene
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Bisabolanes
    C16028  Amorpha-4,11-diene
Other DBs
PubChem: 47205338
ChEBI: 52026
LIPIDMAPS: LMPR0103330005
KNApSAcK: C00017520 C00034408
PDB-CCD: SJA[PDBj]
NIKKAJI: J1.220.953C
LinkDB
KCF data

ATOM        15
            1   C1x C    17.3600  -14.7000
            2   C1x C    17.3600  -16.1000
            3   C1y C    18.5500  -16.8000
            4   C1y C    19.8100  -16.1000
            5   C1y C    19.8100  -14.7000
            6   C1y C    18.5500  -14.0000
            7   C1x C    21.0000  -16.8000
            8   C1x C    22.1900  -16.1000
            9   C2y C    22.1900  -14.7000
            10  C2x C    21.0000  -14.0000
            11  C1a C    18.5500  -18.2000
            12  C2c C    18.5500  -12.6000
            13  C1a C    17.3600  -11.9000
            14  C2a C    19.7400  -11.9000
            15  C1a C    23.3800  -14.0000
BOND        16
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 2
            11    5  10 1
            12    3  11 1 #Down
            13    6  12 1 #Up
            14   12  13 1
            15   12  14 2
            16    9  15 1

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