KEGG   COMPOUND: C07177Help
Entry
C07177                      Compound                               

Name
Methicillin
Formula
C17H20N2O6S
Exact mass
380.1042
Mol weight
380.4155
Structure
Mol fileKCF fileDB search
Remark
ATC code: J01CF03
Drug group: DG02500
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01C BETA-LACTAM ANTIBACTERIALS, PENICILLINS
    J01CF Beta-lactamase resistant penicillins
     J01CF03 Meticillin
      C07177  Methicillin
BRITE hierarchy
Other DBs
CAS: 61-32-5
PubChem: 9386
ChEBI: 6827
ChEMBL: CHEMBL575 CHEMBL84001
PDB-CCD: MII[PDBj]
NIKKAJI: J2.341H
LinkDB All DBs
KCF data Show

ATOM        26
            1   C1y C    26.9117  -15.5512
            2   C5x C    26.9117  -16.9469
            3   N1y N    28.3074  -16.9469
            4   C1y C    28.3074  -15.5512
            5   C1y C    29.6334  -17.3656
            6   C1z C    30.4709  -16.2490
            7   S2x S    29.6334  -15.1324
            8   C1a C    31.4479  -17.2261
            9   C1a C    31.4479  -15.2720
            10  C6a C    30.1219  -18.7615
            11  O6a O    31.5177  -18.7615
            12  O6a O    29.2845  -19.8781
            13  N1b N    25.7253  -14.8533
            14  C5a C    24.5388  -15.5512
            15  O5x O    25.7253  -17.6448
            16  O5a O    24.5388  -16.9469
            17  C8y C    23.2826  -14.8533
            18  C8y C    23.2826  -13.4468
            19  C8x C    22.0646  -12.7435
            20  C8x C    20.8465  -13.4468
            21  C8x C    20.8465  -14.8533
            22  C8y C    22.0646  -15.5565
            23  O2a O    24.4834  -12.7536
            24  C1a C    24.4834  -11.3471
            25  O2a O    22.0645  -16.9778
            26  C1a C    20.8526  -17.6775
BOND        28
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     1   4 1
            5     3   5 1
            6     5   6 1
            7     6   7 1
            8     4   7 1
            9     6   8 1
            10    6   9 1
            11    5  10 1 #Down
            12   10  11 1
            13   10  12 2
            14    1  13 1 #Up
            15   13  14 1
            16    2  15 2
            17   14  16 2
            18   14  17 1
            19   17  18 2
            20   18  19 1
            21   19  20 2
            22   20  21 1
            23   21  22 2
            24   17  22 1
            25   18  23 1
            26   23  24 1
            27   22  25 1
            28   25  26 1

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