KEGG   COMPOUND: C11884Help
Entry
C11884                      Compound                               

Name
Neoabietinol;
Neoabietol
Formula
C20H32O
Exact mass
288.2453
Mol weight
288.4675
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00904  Diterpenoid biosynthesis
map01110  Biosynthesis of secondary metabolites
Enzyme
1.14.13.-
Brite
Lipids [BR:br08002]
 PR  Prenol Lipids
  PR01 Isoprenoids
   PR0104 C20 isoprenoids (diterpenes)
    PR010405 Abietane diterpenoids
     C11884  Neoabietinol
BRITE hierarchy
Other DBs
CAS: 640-42-6
PubChem: 14046
ChEBI: 29654
3DMET: B04363
NIKKAJI: J428.787H
KCF data Show

ATOM        21
            1   C1z C    23.7318  -22.8709
            2   C1b C    23.1545  -24.0785
            3   C1a C    24.4327  -24.4285
            4   O1a O    22.0111  -24.5741
            5   C2y C    28.6094  -18.6771
            6   C1x C    26.1765  -18.6676
            7   C1x C    27.4123  -17.9816
            8   C1y C    26.1767  -20.0698
            9   C1x C    26.1645  -22.8924
            10  C1x C    27.3914  -22.1850
            11  C2c C    29.8139  -17.9755
            12  C1y C    24.9616  -22.1881
            13  C1z C    24.9813  -20.7794
            14  C1x C    23.7710  -20.0534
            15  C1x C    22.5411  -20.7435
            16  C1x C    22.5215  -22.1521
            17  C1a C    24.9616  -19.3740
            18  C2x C    28.5990  -20.0590
            19  C2y C    27.3914  -20.7513
            20  C1a C    29.8070  -16.5770
            21  C1a C    31.0148  -18.6607
BOND        23
            1     2   4 1
            2     1   2 1 #Down
            3     1   3 1 #Up
            4    13  14 1
            5    14  15 1
            6    15  16 1
            7    16   1 1
            8     1  12 1
            9    13   8 1
            10    8  19 1
            11    7   6 1
            12    5  11 2
            13   13  17 1 #Up
            14    5  18 1
            15    8   6 1
            16   18  19 2
            17   12   9 1
            18   11  20 1
            19    5   7 1
            20   11  21 1
            21    9  10 1
            22   19  10 1
            23   12  13 1

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