KEGG   COMPOUND: C19746
Entry
C19746                      Compound                               
Name
(3R,6E)-Nerolidol
Formula
C15H26O
Exact mass
222.1984
Mol weight
222.3663
Structure
Reaction
R09618
Pathway
map00909  Sesquiterpenoid and triterpenoid biosynthesis
Enzyme
4.2.3.49
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Farnesenes
    C19746  (3R,6E)-Nerolidol
Other DBs
CAS: 7212-44-4
PubChem: 135626213
KNApSAcK: C00029339
PDB-CCD: 28U[PDBj]
LinkDB
KCF data

ATOM        16
            1   C1a C    15.4748  -17.2288
            2   C2c C    16.6878  -16.5285
            3   C2b C    17.9008  -17.2288
            4   C1b C    19.1138  -16.5285
            5   C1b C    20.3267  -17.2288
            6   C2c C    21.5398  -16.5285
            7   C2b C    22.7527  -17.2288
            8   C1b C    23.9657  -16.5285
            9   C1b C    25.1787  -17.2288
            10  C1d C    26.3917  -16.5285
            11  C1a C    16.6878  -15.1280
            12  C1a C    21.5398  -15.1281
            13  C2b C    27.6107  -17.2323
            14  C2a C    28.8098  -16.5399
            15  O1a O    25.6914  -15.3155
            16  C1a C    27.0920  -15.3155
BOND        15
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 2
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10    2  11 1
            11    6  12 1
            12   10  13 1
            13   13  14 2
            14   10  15 1 #Up
            15   10  16 1 #Down

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