KEGG   COMPOUND: C20283
Entry
C20283                      Compound                               
Name
1-(3,4-Dihydroxyphenylazo)-2-naphthol;
3',4'-diOH-Sudan I
Formula
C16H12N2O3
Exact mass
280.0848
Mol weight
280.2781
Structure
Pathway
map05204  Chemical carcinogenesis - DNA adducts
Other DBs
PubChem: 163312023
ChEBI: 179844
LinkDB
KCF data

ATOM        21
            1   C8y C    21.0433  -16.5208
            2   C8y C    22.2563  -15.8223
            3   C8x C    22.2579  -14.4226
            4   C8x C    21.0465  -13.7213
            5   C8y C    19.8336  -14.4198
            6   C8y C    19.8320  -15.8195
            7   C8x C    21.0417  -17.9205
            8   C8x C    22.2531  -18.6218
            9   C8x C    23.4662  -17.9233
            10  C8x C    23.4678  -16.5236
            11  N2b N    18.6191  -16.5179
            12  N2b N    17.4244  -15.8264
            13  O1a O    18.6032  -13.7078
            14  C8y C    16.2113  -16.5250
            15  C8x C    15.0168  -15.8337
            16  C8y C    13.8039  -16.5325
            17  C8y C    13.8026  -17.9322
            18  C8x C    14.9973  -18.6235
            19  C8x C    16.2101  -17.9247
            20  O1a O    12.5537  -18.6511
            21  O1a O    12.5763  -15.8222
BOND        23
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     1   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11    2  10 1
            12    6  11 1
            13   11  12 2
            14    5  13 1
            15   12  14 1
            16   14  15 2
            17   15  16 1
            18   16  17 2
            19   17  18 1
            20   18  19 2
            21   14  19 1
            22   17  20 1
            23   16  21 1

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