KEGG   COMPOUND: C16748
Entry
C16748                      Compound                               
Name
Patulin
Formula
C7H6O4
Exact mass
154.0266
Mol weight
154.1201
Structure
Brite
Natural toxins [BR:br08009]
 Fungal toxins
  Mycotoxins
   Others
    C16748  Patulin
Other DBs
CAS: 149-29-1
PubChem: 96023272
ChEBI: 74926
KNApSAcK: C00024000
NIKKAJI: J2.963G
KCF data

ATOM        11
            1   O2x O    30.7722  -21.3168
            2   C1x C    30.7705  -19.9143
            3   C2x C    29.5551  -19.2146
            4   C2y C    28.3414  -19.9173
            5   C2y C    28.3431  -21.3199
            6   C1y C    29.5586  -22.0195
            7   O7x O    27.0070  -19.4856
            8   C7x C    26.1841  -20.6212
            9   C2x C    27.0098  -21.7548
            10  O6a O    24.8110  -20.6229
            11  O1a O    29.5604  -23.4218
BOND        12
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    5   9 2
            11    8  10 2
            12    6  11 1

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Chemical substance (6)   
   PubChem (1)   
   ChEBI (1)   
   HMDB (1)   
   HSDB (1)   
   KNApSAcK (1)   
   NIKKAJI (1)   
All databases (6)   

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