KEGG   COMPOUND: C09118Help
Entry
C09118                      Compound                               

Name
Isopimaric acid
Formula
C20H30O2
Exact mass
302.2246
Mol weight
302.451
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00904  Diterpenoid biosynthesis
map01110  Biosynthesis of secondary metabolites
Brite
Lipids [BR:br08002]
 PR  Prenol Lipids
  PR01 Isoprenoids
   PR0104 C20 isoprenoids (diterpenes)
    PR010408 Pimarane diterpenoids
     C09118  Isopimaric acid
Phytochemical compounds [BR:br08003]
 Terpenoids
  Diterpenoids (C20)
   Pimaranes
    C09118  Isopimaric acid
BRITE hierarchy
Other DBs
CAS: 5835-26-7
PubChem: 11310
ChEBI: 6039
ChEMBL: CHEMBL512164
LIPIDMAPS: LMPR0104080010
KNApSAcK: C00003444
3DMET: B02695
NIKKAJI: J8.075F
LinkDB All DBs
KCF data Show

ATOM        22
            1   C1y C    24.9175  -21.3384
            2   C1z C    24.9233  -19.9311
            3   C1z C    23.7088  -22.0448
            4   C1x C    26.1202  -22.0508
            5   C1y C    26.1378  -19.2421
            6   C1x C    23.7088  -19.2364
            7   C1a C    24.9116  -18.5299
            8   C1x C    22.4885  -21.3442
            9   C2x C    27.3406  -21.3558
            10  C2y C    27.3406  -19.9545
            11  C1x C    26.1436  -17.8409
            12  C1x C    22.4885  -19.9311
            13  C1x C    28.5609  -19.2597
            14  C1x C    27.3640  -17.1460
            15  C1z C    28.5726  -17.8584
            16  C1a C    28.5669  -16.1770
            17  C1a C    24.4839  -23.5975
            18  C6a C    23.0573  -23.4575
            19  O6a O    23.4171  -24.8050
            20  O6a O    21.6604  -23.4510
            21  C2b C    29.7787  -17.1504
            22  C2a C    30.9935  -17.8403
BOND        24
            1     2   6 1
            2     2   7 1 #Up
            3     3   8 1
            4     4   9 1
            5     5  10 1
            6     5  11 1
            7     6  12 1
            8    10  13 1
            9    11  14 1
            10   13  15 1
            11   15  16 1 #Up
            12    8  12 1
            13    9  10 2
            14   14  15 1
            15    3  17 1 #Up
            16    1   2 1
            17    3  18 1 #Down
            18    1   3 1
            19   18  19 1
            20    1   4 1
            21   18  20 2
            22   15  21 1 #Down
            23    2   5 1
            24   21  22 2

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