KEGG   COMPOUND: C12616Help
Entry
C12616                      Compound                               

Name
Sulfamethopyrazine;
Sulfalene
Formula
C11H12N4O3S
Exact mass
280.063
Mol weight
280.303
Structure
Mol fileKCF fileDB search
Remark
Same as: D01216
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01E SULFONAMIDES AND TRIMETHOPRIM
    J01ED Long-acting sulfonamides
     J01ED02 Sulfalene
      D01216  Sulfalene (USAN)
BRITE hierarchy
Other DBs
CAS: 152-47-6
PubChem: 583006
ChEBI: 32162
ChEMBL: CHEMBL1525826
NIKKAJI: J3.271I
LinkDB All DBs
KCF data Show

ATOM        19
            1   C8y C    28.6970  -17.0550
            2   C8y C    28.6970  -15.6543
            3   N5x N    29.9129  -14.9540
            4   C8x C    31.1217  -15.6543
            5   C8x C    31.1217  -17.0550
            6   N5x N    29.9129  -17.7553
            7   O2a O    27.4845  -14.9533
            8   N1b N    27.4845  -17.7560
            9   S4a S    26.2711  -17.0562
            10  C8y C    25.0584  -17.7572
            11  C8x C    25.0642  -19.1520
            12  C8x C    23.8515  -19.8530
            13  C8y C    22.6381  -19.1534
            14  C8x C    22.6374  -17.7527
            15  C8x C    23.8499  -17.0517
            16  N1a N    21.4256  -19.8544
            17  C1a C    27.4851  -13.5527
            18  O3c O    25.2733  -16.0716
            19  O3c O    27.2610  -16.0716
BOND        20
            1     3   4 2
            2     9  10 1
            3     4   5 1
            4     5   6 2
            5     6   1 1
            6     2   7 1
            7    10  11 2
            8    11  12 1
            9    12  13 2
            10   13  14 1
            11   14  15 2
            12   15  10 1
            13    1   2 2
            14   13  16 1
            15    1   8 1
            16    7  17 1
            17    2   3 1
            18    9  18 2
            19    8   9 1
            20    9  19 2

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