KEGG   COMPOUND: C09294Help
Entry
C09294                      Compound                               

Name
Anisatin
Formula
C15H20O8
Exact mass
328.1158
Mol weight
328.3145
Structure
Mol fileKCF fileDB searchJmolKegDraw
Comment
Sesquiterpene lactones
Source: Illicium anisatum [TAX:124794]
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Others
    C09294  Anisatin
Natural toxins [BR:br08009]
 Phytotoxins
  Terpenoids
   Sesquiterpenoids
    C09294  Anisatin
BRITE hierarchy
Other DBs
CAS: 
5230-87-5
PubChem: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        23
            1   C1z C    24.8542  -15.5497
            2   C1z C    24.8542  -16.9475
            3   C1x C    26.0705  -14.8479
            4   C1y C    23.5207  -15.1171
            5   C1y C    24.8425  -14.1462
            6   C1z C    26.0645  -17.6550
            7   C1y C    23.5266  -17.3861
            8   O1a O    24.4856  -18.4383
            9   C1y C    27.2751  -15.5497
            10  C1x C    22.7020  -16.2515
            11  C1a C    22.3807  -14.3328
            12  C7x C    26.0471  -13.4678
            13  O1a O    23.6319  -13.3686
            14  C1z C    27.2751  -16.9475
            15  C7x C    27.0529  -18.7892
            16  C1x C    25.0646  -18.6434
            17  O1a O    22.7438  -18.5735
            18  O7x O    27.3334  -14.1521
            19  O6a O    26.0530  -12.0642
            20  C1a C    28.6729  -16.9475
            21  O1a O    28.2635  -17.9357
            22  O7x O    26.0588  -19.6376
            23  O6a O    28.4505  -18.7251
BOND        26
            1     1   2 1
            2     1   3 1 #Down
            3     1   4 1
            4     1   5 1
            5     2   6 1
            6     2   7 1
            7     2   8 1 #Down
            8     9   3 1 #Down
            9     4  10 1
            10    4  11 1 #Up
            11    5  12 1
            12    5  13 1 #Up
            13    6  14 1
            14    6  15 1 #Down
            15    6  16 1 #Up
            16    7  17 1 #Down
            17    9  18 1
            18   12  19 2
            19   14  20 1 #Up
            20   14  21 1 #Down
            21   15  22 1
            22   15  23 2
            23    7  10 1
            24    9  14 1
            25   12  18 1
            26   16  22 1

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