KEGG   COMPOUND: C21822Help
Entry
C21822                      Compound                               

Name
Sugiol;
12-Hydroxyabieta-8,11,13-trien-7-one
Formula
C20H28O2
Exact mass
300.2089
Mol weight
300.4351
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00904  Diterpenoid biosynthesis
map01110  Biosynthesis of secondary metabolites
Enzyme
Other DBs
CAS: 511-05-7
ChEMBL: CHEMBL195296
KCF data Show

ATOM        22
            1   C8y C    18.0120  -15.8394
            2   C1z C    16.8206  -16.4701
            3   C8y C    19.2035  -16.5402
            4   C8x C    18.0120  -14.4376
            5   C1y C    16.8206  -17.8718
            6   C1x C    15.6291  -15.8394
            7   C1a C    16.8206  -14.9983
            8   C8x C    20.3949  -15.8394
            9   C5x C    19.2035  -17.8718
            10  C8y C    19.2035  -13.7368
            11  C1z C    15.6291  -18.5727
            12  C1x C    18.0120  -18.5727
            13  C1x C    14.4376  -16.4701
            14  C8y C    20.3949  -14.4376
            15  O1a O    19.2036  -12.3351
            16  C1x C    14.4376  -17.8718
            17  C1a C    14.7881  -19.9744
            18  C1a C    16.3300  -20.0445
            19  C1c C    21.6565  -13.7368
            20  C1a C    22.8479  -14.4376
            21  C1a C    21.6565  -12.4052
            22  O5x O    20.4159  -18.5718
BOND        24
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     2   7 1 #Up
            7     3   8 1
            8     3   9 1
            9     4  10 2
            10    5  11 1
            11    5  12 1
            12    6  13 1
            13    8  14 2
            14   10  15 1
            15   11  16 1
            16   11  17 1
            17   11  18 1
            18   14  19 1
            19   19  20 1
            20   19  21 1
            21    9  12 1
            22   10  14 1
            23   13  16 1
            24    9  22 2

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