KEGG   COMPOUND: C16765Help
Entry
C16765                      Compound                               

Name
Citrinin
Formula
C13H14O5
Exact mass
250.0841
Mol weight
250.2473
Structure
Mol fileKCF fileDB searchJmolKegDraw
Brite
Carcinogens [BR:br08008]
 Group 3: Not classifiable as to its carcinogenicity to humans
  Compounds
   C16765  Citrinin
Natural toxins [BR:br08009]
 Fungal toxins
  Mycotoxins
   Others
    C16765  Citrinin
BRITE hierarchy
Other DBs
CAS: 
518-75-2
PubChem: 
ChEBI: 
KNApSAcK: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        18
            1   C2y C    25.9928  -20.6034
            2   C5x C    25.9928  -22.0054
            3   C2y C    27.2069  -22.7063
            4   C2y C    28.4211  -22.0054
            5   C2y C    28.4211  -20.6034
            6   C2y C    27.2069  -19.9024
            7   C1y C    29.6352  -22.7063
            8   C1y C    30.8493  -22.0054
            9   O2x O    30.8493  -20.6034
            10  C2x C    29.6352  -19.9024
            11  O1a O    27.2069  -18.5006
            12  C6a C    24.7787  -19.9024
            13  O5x O    24.7787  -22.7063
            14  C1a C    29.6352  -24.1082
            15  C1a C    32.0486  -22.6978
            16  C1a C    27.2069  -24.1080
            17  O6a O    23.5815  -20.5938
            18  O6a O    24.7786  -18.5006
BOND        19
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     1   6 2
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 2
            12    6  11 1
            13    1  12 1
            14    2  13 2
            15    7  14 1 #Up
            16    8  15 1 #Down
            17    3  16 1
            18   12  17 1
            19   12  18 2

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