KEGG   COMPOUND: C07224
Entry
C07224                      Compound                               
Name
Milrinone
Formula
C12H9N3O
Exact mass
211.0746
Mol weight
211.2194
Structure
Remark
Same as: D00417
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C01 CARDIAC THERAPY
   C01C CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
    C01CE Phosphodiesterase inhibitors
     C01CE02 Milrinone
      D00417  Milrinone (JAN/USP/INN) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  21  Cardiovascular agents
   211  Cardiotonics
    2119  Others
     D00417  Milrinone (JAN/USP/INN)
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01703  Cardiotonic
   DG01757  Amrinone type cardiotonic
    DG00229  Milrinone
     D00417  Milrinone
  DG01507  Phosphodiesterase III inhibitor
   DG01757  Amrinone type cardiotonic
    DG00229  Milrinone
     D00417  Milrinone
 Metabolizing enzyme substrate
  DG02924  UGT substrate
   DG00229  Milrinone
    D00417  Milrinone
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases (EC3)
   Phosphodiesterases
    PDE3
     D00417  Milrinone (JAN/USP/INN) <JP>
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D00417
Other DBs
CAS: 78415-72-2
PubChem: 9433
ChEBI: 50693
PDB-CCD: MIL[PDBj]
NIKKAJI: J23.655A
KCF data

ATOM        16
            1   C8y C    25.7072  -17.3482
            2   C8y C    26.9190  -16.6491
            3   C8x C    24.5013  -16.6491
            4   C8y C    25.7072  -18.7463
            5   C8x C    28.1309  -17.3482
            6   C8x C    26.9190  -15.2508
            7   C8y C    23.2836  -17.3482
            8   N4x N    24.5013  -19.4514
            9   C1a C    26.9132  -19.4455
            10  C8x C    29.3485  -16.6608
            11  C8x C    28.1366  -14.5517
            12  C8y C    23.2836  -18.7463
            13  C3b C    22.0719  -16.6491
            14  N5x N    29.3485  -15.2508
            15  O5x O    22.0719  -19.4514
            16  N3a N    20.8600  -15.9500
BOND        17
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 2
            5     2   6 1
            6     3   7 2
            7     4   8 1
            8     4   9 1
            9     5  10 1
            10    6  11 2
            11    7  12 1
            12    7  13 1
            13   10  14 2
            14   12  15 2
            15   13  16 3
            16    8  12 1
            17   11  14 1

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