KEGG   COMPOUND: C00779
Entry
C00779                      Compound                               

Name
Scytalone;
3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone
Formula
C10H10O4
Exact mass
194.0579
Mol weight
194.184
Structure
Reaction
Enzyme
1.1.1.252       4.2.1.94
Other DBs
CAS: 49598-85-8
PubChem: 4040
ChEBI: 16945
NIKKAJI: J20.775F
KCF data

ATOM        14
            1   C8y C    22.1137  -17.5587
            2   C8y C    22.1137  -16.1565
            3   C8x C    20.8961  -18.2663
            4   C1x C    23.3374  -18.2663
            5   C8y C    20.8961  -15.4681
            6   C5x C    23.3311  -15.4489
            7   C8y C    19.6979  -17.5587
            8   C1y C    24.5613  -17.5652
            9   C8x C    19.6979  -16.1565
            10  O1a O    20.8961  -14.0784
            11  C1x C    24.5548  -16.1500
            12  O5x O    23.3247  -14.0594
            13  O1a O    18.5631  -18.1771
            14  O1a O    25.8359  -18.3299
BOND        15
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     4   8 1
            8     5   9 2
            9     5  10 1
            10    6  11 1
            11    6  12 2
            12    7  13 1
            13    8  14 1 #Up
            14    7   9 1
            15    8  11 1

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