KEGG   COMPOUND: C10946Help
Entry
C10946                      Compound                               

Name
Metsulfuron-methyl;
Metsulfuron methyl
Formula
C14H15N5O6S
Exact mass
381.0743
Mol weight
381.3638
Structure
Mol fileKCF fileDB searchJmolKegDraw
Brite
Pesticides [BR:br08007]
 Pesticides
  Herbicides
   Sulfonylurea herbicides
    C10946  Metsulfuron-methyl
BRITE hierarchy
Other DBs
CAS: 
74223-64-6
PubChem: 
ChEBI: 
ChEMBL: 
PDB-CCD: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        26
            1   N5x N    26.5300  -19.7400
            2   C8y C    25.2700  -20.4400
            3   N5x N    24.0800  -19.7400
            4   C8y C    24.0800  -18.3400
            5   N5x N    25.2700  -17.6400
            6   C8y C    26.5300  -18.3400
            7   O2a O    22.8900  -17.6400
            8   C1a C    25.2700  -21.8400
            9   C8x C    35.0000  -17.6400
            10  C8x C    35.0000  -16.2400
            11  C8x C    33.7400  -15.5400
            12  C8y C    32.5500  -16.2400
            13  C8y C    32.5500  -17.6400
            14  C8x C    33.7400  -18.3400
            15  S4a S    31.3600  -18.3400
            16  N1b N    30.1700  -17.6400
            17  C5a C    28.9100  -18.3400
            18  N1b N    27.7200  -17.6400
            19  C7a C    31.3600  -15.5400
            20  O7a O    30.1700  -16.2400
            21  O6a O    31.3600  -14.1400
            22  O3c O    32.3400  -19.3900
            23  O3c O    30.6600  -19.5300
            24  O5a O    28.9100  -19.7400
            25  C1a C    28.9100  -15.5400
            26  C1a C    21.7000  -18.3400
BOND        27
            1    12  13 1
            2    13  14 2
            3    14   9 1
            4     4   7 1
            5    13  15 1
            6     1   2 1
            7    15  16 1
            8     2   8 1
            9    16  17 1
            10    2   3 2
            11   17  18 1
            12    3   4 1
            13   12  19 1
            14    4   5 2
            15   19  20 1
            16    5   6 1
            17   19  21 2
            18    6   1 2
            19   15  22 2
            20   15  23 2
            21    9  10 2
            22   17  24 2
            23   18   6 1
            24   10  11 1
            25   20  25 1
            26   11  12 2
            27    7  26 1

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