KEGG   COMPOUND: C11326Help
Entry
C11326                      Compound                               

Name
8-Anilino-1-naphthalene sulfonic acid;
1-Anilino-8-naphthalenesulfonate;
ANS
Formula
C16H13NO3S
Exact mass
299.0616
Mol weight
299.3443
Structure
Mol fileKCF fileDB searchJmolKegDraw
Other DBs
CAS: 
82-76-8
PubChem: 
ChEBI: 
PDB-CCD: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        21
            1   C8x C    27.5402  -18.3612
            2   C8x C    27.5402  -19.7599
            3   C8x C    28.7545  -20.4593
            4   C8y C    28.7545  -17.6618
            5   C8y C    29.9617  -18.3612
            6   C8y C    29.9557  -19.7599
            7   C8x C    31.1641  -20.4646
            8   C8x C    32.3784  -19.7703
            9   C8x C    32.3845  -18.3715
            10  C8y C    31.1761  -17.6670
            11  N1b N    28.7413  -16.2630
            12  C8y C    27.5261  -15.5636
            13  C8x C    27.5243  -14.1617
            14  C8x C    26.3091  -13.4623
            15  C8x C    25.0960  -14.1649
            16  C8x C    25.0979  -15.5669
            17  C8x C    26.3129  -16.2662
            18  S4a S    31.1643  -16.2630
            19  O1d O    29.7586  -16.2137
            20  O1d O    32.5630  -16.2073
            21  O1d O    31.1573  -14.8643
BOND        23
            1     4  11 1
            2     1   2 2
            3    11  12 1
            4     2   3 1
            5     3   6 2
            6     5   4 2
            7     4   1 1
            8     5   6 1
            9    12  13 2
            10   13  14 1
            11   14  15 2
            12   15  16 1
            13   16  17 2
            14   17  12 1
            15    6   7 1
            16   10  18 1
            17    7   8 2
            18   18  19 2
            19    8   9 1
            20   18  20 2
            21    9  10 2
            22   18  21 1
            23   10   5 1

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