KEGG   DRUG: OprozomibHelp
Entry
D10318                      Drug                                   

Name
Oprozomib (USAN/INN)
Formula
C25H32N4O7S
Exact mass
532.1992
Mol weight
532.6092
Structure
Mol fileKCF fileDB search
Efficacy
Antineoplastic, Proteasome inhibitor
Target
PSMB5 [HSA:5693] [KO:K02737]
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases (EC3)
   Threonine peptidases
    PSMB5
     D10318  Oprozomib (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 935888-69-0
PubChem: 163312348
ChEMBL: CHEMBL2103884
LinkDB All DBs
KCF data Show

ATOM        37
            1   C8x C     9.5200  -22.4000
            2   C8y C     9.5200  -21.0000
            3   S2x S     8.1900  -20.5800
            4   C8y C     7.3500  -21.7000
            5   N5x N     8.1900  -22.8200
            6   C5a C    10.7100  -20.3000
            7   N1b N    11.9000  -21.0000
            8   O5a O    10.7100  -18.9000
            9   C1c C    13.0900  -20.3000
            10  C5a C    14.2800  -21.0000
            11  N1b N    15.4700  -20.3000
            12  O5a O    14.2800  -22.4000
            13  C1c C    16.6600  -21.0000
            14  C5a C    17.9200  -20.3000
            15  N1b N    19.1100  -21.0700
            16  O5a O    17.9200  -18.9000
            17  C1c C    20.3000  -20.3700
            18  C5a C    21.4900  -21.0700
            19  O5a O    21.4900  -22.4700
            20  C1a C     5.9500  -21.7000
            21  C1b C    13.0900  -18.9000
            22  O2a O    14.2800  -18.1300
            23  C1a C    14.2800  -16.7300
            24  C1b C    20.3000  -18.7600
            25  C8y C    21.4900  -18.0600
            26  C1b C    16.6600  -22.4000
            27  O2a O    17.8500  -23.1000
            28  C1a C    17.8500  -24.5000
            29  C1z C    22.6800  -20.3700
            30  C8x C    21.4900  -16.6600
            31  C8x C    22.6800  -18.7600
            32  C8x C    23.9400  -18.0600
            33  C8x C    23.9400  -16.6600
            34  C8x C    22.6800  -15.9600
            35  C1a C    23.8700  -21.0700
            36  O2x O    21.9800  -19.1800
            37  C1x C    23.3800  -19.1800
BOND        39
            1     1   2 2
            2     2   3 1
            3     3   4 1
            4     4   5 2
            5     1   5 1
            6     2   6 1
            7     6   7 1
            8     6   8 2
            9     7   9 1
            10    9  10 1
            11   10  11 1
            12   10  12 2
            13   11  13 1
            14   13  14 1
            15   14  15 1
            16   14  16 2
            17   15  17 1
            18   17  18 1
            19   18  19 2
            20    4  20 1
            21    9  21 1 #Up
            22   21  22 1
            23   22  23 1
            24   17  24 1 #Up
            25   24  25 1
            26   13  26 1 #Down
            27   26  27 1
            28   27  28 1
            29   29  18 1 #Down
            30   30  25 2
            31   31  32 2
            32   32  33 1
            33   33  34 2
            34   30  34 1
            35   31  25 1
            36   29  35 1 #Up
            37   36  37 1
            38   37  29 1
            39   29  36 1

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