KEGG   COMPOUND: C19525
Entry
C19525                      Compound                               
Name
Sudan I;
C.I. Solvent Yellow 14
Formula
C16H12N2O
Exact mass
248.095
Mol weight
248.2793
Structure
Pathway
map05204  Chemical carcinogenesis - DNA adducts
Other DBs
CAS: 842-07-9
PubChem: 124490197
ChEBI: 30958
KCF data

ATOM        19
            1   C8y C    12.2374  -15.8247
            2   C8y C    13.4506  -15.1261
            3   C8x C    13.4522  -13.7261
            4   C8x C    12.2406  -13.0247
            5   C8y C    11.0274  -13.7233
            6   C8y C    11.0258  -15.1233
            7   C8x C    12.2358  -17.2247
            8   C8x C    13.4474  -17.9261
            9   C8x C    14.6607  -17.2275
            10  C8x C    14.6623  -15.8275
            11  N2b N     9.8127  -15.8218
            12  N2b N     8.6178  -15.1302
            13  O1a O     9.7968  -13.0112
            14  C8y C     7.4045  -15.8289
            15  C8x C     6.2097  -15.1375
            16  C8x C     4.9966  -15.8364
            17  C8x C     4.9953  -17.2364
            18  C8x C     6.1902  -17.9278
            19  C8x C     7.4033  -17.2289
BOND        21
            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

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