KEGG   COMPOUND: C09069Help
Entry
C09069                      Compound                               

Name
Carnosol
Formula
C20H26O4
Exact mass
330.1831
Mol weight
330.418
Structure
Mol fileKCF fileDB search
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Diterpenoids (C20)
   Abietanes
    C09069  Carnosol
BRITE hierarchy
Other DBs
CAS: 5957-80-2
PubChem: 11261
ChEBI: 3429
ChEMBL: CHEMBL218693
KNApSAcK: C00003410
3DMET: B02657
NIKKAJI: J39.959K
LinkDB All DBs
KCF data Show

ATOM        24
            1   C1z C    16.8742  -16.4511
            2   C8y C    18.1108  -15.7841
            3   C1y C    16.8686  -17.8028
            4   C7x C    16.8628  -15.0996
            5   C1x C    15.7126  -15.7783
            6   C8y C    19.2037  -16.4685
            7   C8y C    18.1233  -14.4325
            8   C1x C    18.0303  -18.4816
            9   C1z C    15.7126  -18.4756
            10  O7x O    18.1051  -17.1183
            11  O6a O    15.6895  -14.4268
            12  C1x C    14.5451  -16.4511
            13  C1y C    19.2037  -17.8144
            14  C8x C    20.3769  -15.7955
            15  C8y C    19.2267  -13.7710
            16  O1a O    16.9663  -13.6101
            17  C1x C    14.5451  -17.8028
            18  C1a C    15.0224  -19.9136
            19  C1a C    16.4660  -19.9825
            20  C8y C    20.3884  -14.4497
            21  O1a O    19.2382  -12.4195
            22  C1c C    21.5617  -13.7883
            23  C1a C    22.7235  -14.4727
            24  C1a C    21.5743  -12.4425
BOND        27
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Up
            4     1   5 1
            5     2   6 2
            6     2   7 1
            7     3   8 1
            8     3   9 1
            9     4  10 1
            10    4  11 2
            11    5  12 1
            12    6  13 1
            13    6  14 1
            14    7  15 2
            15    7  16 1
            16    9  17 1
            17    9  18 1
            18    9  19 1
            19   14  20 2
            20   15  21 1
            21   20  22 1
            22   22  23 1
            23   22  24 1
            24    8  13 1
            25   13  10 1 #Up
            26   12  17 1
            27   15  20 1

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