KEGG   COMPOUND: C19755
Entry
C19755                      Compound                               
Name
Patchoulol
Formula
C15H26O
Exact mass
222.1984
Mol weight
222.37
Structure
Reaction
R09629
Pathway
map00909  Sesquiterpenoid and triterpenoid biosynthesis
Enzyme
4.2.3.70
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Bisabolanes
    C19755  Patchoulol
Other DBs
PubChem: 135626222
KNApSAcK: C00003168
LinkDB
KCF data

ATOM        16
            1   C1x C    12.8100  -17.4300
            2   C1x C    12.1100  -18.6424
            3   C1y C    13.0468  -19.6828
            4   C1y C    14.3258  -19.1134
            5   C1z C    14.1794  -17.7211
            6   C1z C    15.2420  -16.7640
            7   C1x C    16.6420  -16.7640
            8   C1x C    17.3420  -17.9764
            9   C1y C    16.9797  -19.3287
            10  C1x C    15.7672  -20.0287
            11  C1a C    14.8797  -15.4117
            12  O1a O    13.4794  -16.5086
            13  C1a C    12.7571  -21.0451
            14  C1z C    15.8117  -18.2934
            15  C1a C    16.3116  -17.6535
            16  C1a C    15.2300  -18.9961
BOND        18
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     1   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10   10   4 1
            11    6   4 1
            12    6  11 1
            13    5  12 1
            14    3  13 1 #Up
            15    5  14 1 #Up
            16    9  14 1 #Up
            17   14  15 1
            18   14  16 1

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