KEGG   DRUG: AlfaxaloneHelp
Entry
D07282                      Drug                                   

Name
Alfaxalone (INN)
Formula
C21H32O3
Exact mass
332.2351
Mol weight
332.477
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Neuropsychiatric agent
 DG02030  Anesthetics
  DG02027  General anesthetics
 DG02027  General anesthetics
Remark
ATC code: N01AX05
Efficacy
Anesthetic
Comment
Steroid
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N01 ANESTHETICS
   N01A ANESTHETICS, GENERAL
    N01AX Other general anesthetics
     N01AX05 Alfaxalone
      D07282  Alfaxalone (INN)
Animal drugs in Japan [BR:br08331]
 91  Agents affecting nervous system
  911  General anesthetics
   9119  Other general anesthetics
    D07282  Alfaxalone
BRITE hierarchy
Other DBs
CAS: 23930-19-0
PubChem: 51091619
ChEMBL: CHEMBL190279
PDB-CCD: EY4[PDBj]
LigandBox: D07282
NIKKAJI: J3.157G
LinkDB All DBs
KCF data Show

ATOM        24
            1   C1z C    21.5680  -19.1368
            2   C1y C    21.5680  -20.5020
            3   C1x C    23.9327  -20.5020
            4   C1x C    23.9327  -19.1368
            5   C1y C    22.7503  -18.4542
            6   C1x C    20.3858  -18.4542
            7   C5x C    19.2034  -19.1368
            8   C1y C    19.2034  -20.5020
            9   C1y C    20.3858  -21.1846
            10  C1z C    18.0211  -21.1846
            11  C1y C    18.0211  -22.5498
            12  C1x C    19.2034  -23.2324
            13  C1x C    20.3858  -22.5498
            14  C1x C    16.8389  -20.5020
            15  C1x C    15.6565  -21.1846
            16  C1y C    15.6565  -22.5498
            17  C1x C    16.8389  -23.2324
            18  C5a C    22.7503  -17.0892
            19  C1a C    21.5680  -17.7716
            20  C1a C    18.0211  -19.8194
            21  O1a O    14.4541  -23.2443
            22  O5x O    18.0029  -18.4434
            23  C1a C    23.9162  -16.4158
            24  O5a O    21.5517  -16.3970
BOND        27
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     1   5 1
            6     1   6 1
            7     6   7 1
            8     7   8 1
            9     8   9 1
            10    9   2 1
            11    8  10 1
            12   10  11 1
            13   11  12 1
            14   12  13 1
            15   13   9 1
            16   10  14 1
            17   14  15 1
            18   15  16 1
            19   16  17 1
            20   17  11 1
            21    5  18 1 #Up
            22    1  19 1 #Up
            23   10  20 1 #Up
            24   16  21 1 #Down
            25    7  22 2
            26   18  23 1
            27   18  24 2

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