KEGG   COMPOUND: C10360Help
Entry
C10360                      Compound                               

Name
2-Isoprenylemodin
Formula
C20H18O5
Exact mass
338.1154
Mol weight
338.3539
Structure
Mol fileKCF fileDB search
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK13 Aromatic polyketides
   PK1304 Anthracenes and phenanthrenes
    C10360  2-Isoprenylemodin
Phytochemical compounds [BR:br08003]
 Polyketides
  Anthraquinones
   Anthraquinone type
    C10360  2-Isoprenylemodin
BRITE hierarchy
Other DBs
CAS: 82345-58-2
PubChem: 12546
ChEBI: 1177
LIPIDMAPS: LMPK13040010
KNApSAcK: C00002832
3DMET: B03773
NIKKAJI: J156.709H
KCF data Show

ATOM        25
            1   C8y C    25.9583  -18.5786
            2   C8y C    25.9700  -17.1793
            3   C5x C    24.7457  -19.2842
            4   C8x C    27.1595  -19.2899
            5   C5x C    24.7631  -16.4798
            6   C8y C    27.1828  -16.4972
            7   C8y C    23.5388  -18.5728
            8   O5x O    24.7457  -20.6835
            9   C8y C    28.4481  -18.6019
            10  C8y C    23.5447  -17.1676
            11  O5x O    24.7690  -15.0745
            12  C8y C    28.3897  -17.2026
            13  O1a O    27.1945  -15.0921
            14  C8x C    22.3319  -19.2782
            15  O1a O    29.5850  -19.3132
            16  C8y C    22.3319  -16.4738
            17  C1b C    29.6024  -16.5146
            18  C8y C    21.1133  -18.5728
            19  C8x C    21.1133  -17.1676
            20  O1a O    22.3319  -15.0688
            21  C2b C    30.8093  -17.2202
            22  C1a C    19.9006  -19.2782
            23  C2c C    32.0279  -16.5379
            24  C1a C    33.2289  -17.2376
            25  C1a C    32.0396  -15.1328
BOND        27
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 2
            8     4   9 2
            9     5  10 1
            10    5  11 2
            11    6  12 2
            12    6  13 1
            13    7  14 1
            14    9  15 1
            15   10  16 1
            16   12  17 1
            17   14  18 2
            18   16  19 2
            19   16  20 1
            20   17  21 1
            21   18  22 1
            22   21  23 2
            23   23  24 1
            24   23  25 1
            25    7  10 2
            26    9  12 1
            27   18  19 1

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