KEGG   COMPOUND: C06080Help
Entry
C06080                      Compound                               

Name
Nivalenol
Formula
C15H20O7
Exact mass
312.1209
Mol weight
312.3151
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Sesquiterpenoid and triterpenoid biosynthesis
Brite
Carcinogens [BR:br08008]
 Group 3: Not classifiable as to its carcinogenicity to humans
  Compounds
   C06080  Nivalenol
Natural toxins [BR:br08009]
 Fungal toxins
  Mycotoxins
   Trichothecenes
    C06080  Nivalenol
BRITE hierarchy
Other DBs
CAS: 
23282-20-4
PubChem: 
ChEBI: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        22
            1   C1z C    27.3381  -15.9386
            2   C1z C    26.1767  -16.6145
            3   C1y C    27.3440  -14.5925
            4   C1x C    25.9384  -15.9320
            5   O2x O    26.3306  -15.0365
            6   C1z C    25.0080  -15.9329
            7   C1y C    28.6957  -16.6029
            8   C1a C    26.1650  -17.9545
            9   O2x O    26.1825  -13.9225
            10  C1y C    28.6840  -14.5925
            11  C1y C    25.0140  -14.5868
            12  C1y C    23.8397  -16.6086
            13  C1b C    25.0597  -17.2204
            14  O1a O    29.8523  -17.2788
            15  O1a O    29.8408  -13.9167
            16  C2x C    23.8397  -13.9167
            17  C5x C    22.6653  -15.9329
            18  O1a O    23.1276  -17.6463
            19  O1a O    24.5064  -18.4426
            20  C2y C    22.6653  -14.5868
            21  O5x O    21.5026  -16.5969
            22  C1a C    21.5026  -13.9167
BOND        25
            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     2   8 1 #Up
            8     3   9 1
            9     3  10 1
            10    6  11 1
            11    6  12 1
            12    6  13 1 #Down
            13    7  14 1 #Up
            14   10  15 1 #Down
            15   11  16 1
            16   12  17 1
            17   12  18 1 #Down
            18   13  19 1
            19   16  20 2
            20   17  21 2
            21   20  22 1
            22    4   5 1
            23    7  10 1
            24    9  11 1
            25   17  20 1

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