KEGG   COMPOUND: C11885Help
Entry
C11885                      Compound                               

Name
Neoabietal;
Neoabietinal
Formula
C20H30O
Exact mass
286.2297
Mol weight
286.4516
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
     C11885  Neoabietal
BRITE hierarchy
Other DBs
CAS: 19898-57-8
PubChem: 14047
ChEBI: 29652
3DMET: B04364
NIKKAJI: J428.790H
KCF data Show

ATOM        21
            1   C1z C    23.6981  -22.8712
            2   C4a C    23.1908  -24.0088
            3   C1a C    24.3990  -24.4988
            4   O4a O    21.9774  -24.5744
            5   C2y C    28.5757  -18.6774
            6   C1x C    26.1428  -18.6679
            7   C1x C    27.3786  -17.9819
            8   C1y C    26.1430  -20.0701
            9   C1x C    26.1308  -22.8927
            10  C1x C    27.3576  -22.1853
            11  C2c C    29.7803  -17.9758
            12  C1y C    24.9279  -22.1884
            13  C1z C    24.9476  -20.7797
            14  C1x C    23.7373  -20.0537
            15  C1x C    22.4374  -20.7438
            16  C1x C    22.4878  -22.1524
            17  C1a C    24.9279  -19.3743
            18  C2x C    28.5654  -20.0593
            19  C2y C    27.3576  -20.7516
            20  C1a C    29.7733  -16.5773
            21  C1a C    30.9810  -18.6609
BOND        23
            1     2   4 2
            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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