KEGG   COMPOUND: C10422Help
Entry
C10422                      Compound                               

Name
(-)-Glyceollin II
Formula
C20H18O5
Exact mass
338.1154
Mol weight
338.3539
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Isoflavonoid biosynthesis
Enzyme
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1207 Pterocarpans
    C10422  (-)-Glyceollin II
Phytochemical compounds [BR:br08003]
 Flavonoids
  Isoflavonoids
   Pterocarpans
    C10422  (-)-Glyceollin II
BRITE hierarchy
Other DBs
CAS: 
67314-98-1
PubChem: 
ChEBI: 
LIPIDMAPS: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        25
            1   C1z C    27.8643  -16.1696
            2   C1y C    26.6601  -16.8417
            3   C8y C    28.8871  -17.0931
            4   C1x C    27.8700  -14.7785
            5   O1a O    28.9690  -15.3279
            6   C8y C    25.4678  -16.1462
            7   O2x O    26.9349  -18.1978
            8   C8y C    28.3201  -18.3499
            9   C8x C    30.2725  -16.9587
            10  O2x O    26.6777  -14.0771
            11  C8y C    25.4735  -14.7668
            12  C8x C    24.2695  -16.8477
            13  C8x C    29.1210  -19.4779
            14  C8x C    31.0732  -18.0810
            15  C8x C    24.2695  -14.0654
            16  C8y C    23.0653  -16.1579
            17  C8y C    30.4945  -19.3493
            18  C8y C    23.0653  -14.7668
            19  C2x C    21.8730  -16.8477
            20  O1a O    31.3070  -20.4774
            21  O2x O    21.8730  -14.0654
            22  C2x C    20.6631  -16.1579
            23  C1z C    20.6631  -14.7668
            24  C1a C    19.4590  -14.0654
            25  C1a C    19.4006  -15.6786
BOND        29
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1 #Down
            5     2   6 1
            6     2   7 1
            7     3   8 2
            8     3   9 1
            9     4  10 1
            10    6  11 2
            11    6  12 1
            12    8  13 1
            13    9  14 2
            14   11  15 1
            15   12  16 2
            16   13  17 2
            17   15  18 2
            18   16  19 1
            19   17  20 1
            20   18  21 1
            21   19  22 2
            22   21  23 1
            23   23  24 1
            24   23  25 1
            25    7   8 1
            26   10  11 1
            27   14  17 1
            28   16  18 1
            29   22  23 1

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