KEGG   COMPOUND: C16986
Entry
C16986                      Compound                               

Name
Licoricidin
Formula
C26H32O5
Exact mass
424.225
Mol weight
424.5293
Structure
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1208 Isoflavans
    C16986  Licoricidin
Other DBs
CAS: 30508-27-1
PubChem: 96023472
ChEBI: 69082
ChEMBL: CHEMBL1929043
KNApSAcK: C00009739
NIKKAJI: J885.811J
KCF data

ATOM        31
            1   C8y C    23.1000  -19.1100
            2   C8y C    23.1000  -20.5100
            3   C8y C    24.2900  -21.2100
            4   C8y C    25.5500  -20.5100
            5   C8y C    25.5500  -19.1100
            6   C8x C    24.2900  -18.4100
            7   C1x C    26.7400  -21.2100
            8   C1y C    27.9300  -20.5100
            9   C1x C    27.9300  -19.1100
            10  O2x O    26.7400  -18.4100
            11  C8y C    29.1200  -21.2100
            12  C8x C    29.1200  -22.6100
            13  C8x C    30.3800  -23.3100
            14  C8y C    31.5700  -22.6100
            15  C8y C    31.5700  -21.2100
            16  C8y C    30.3800  -20.5100
            17  O1a O    30.3800  -19.1100
            18  O1a O    32.7600  -23.3100
            19  O2a O    24.2900  -22.6100
            20  O1a O    21.9100  -18.4100
            21  C1a C    25.5024  -23.3100
            22  C1b C    32.7853  -20.5149
            23  C2b C    33.9737  -21.2077
            24  C2c C    35.1701  -20.5235
            25  C1a C    36.3513  -21.2119
            26  C1a C    35.1062  -19.1105
            27  C1b C    21.8847  -21.2051
            28  C2b C    20.6963  -20.5123
            29  C2c C    19.4999  -21.1965
            30  C1a C    18.3187  -20.5081
            31  C1a C    19.5638  -22.6095
BOND        33
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    8  11 1 #Up
            13   11  12 2
            14   12  13 1
            15   13  14 2
            16   14  15 1
            17   15  16 2
            18   11  16 1
            19   16  17 1
            20   14  18 1
            21    3  19 1
            22    1  20 1
            23   19  21 1
            24   15  22 1
            25   22  23 1
            26   23  24 2
            27   24  25 1
            28   24  26 1
            29    2  27 1
            30   27  28 1
            31   28  29 2
            32   29  30 1
            33   29  31 1

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