KEGG   DRUG: Pelubiprofen
Entry
D01865                      Drug                                   
Name
Pelubiprofen (JAN/INN)
Formula
C16H18O3
Exact mass
258.1256
Mol weight
258.3123
Structure
Class
Anti-inflammatory
 DG01504  Nonsteroidal anti-inflammatory drug (NSAID)
  DG01908  Anti-inflammatory drug, propionic acid derivatives
Efficacy
Analgesic, Anti-inflammatory
Interaction
Brite
Drug groups [BR:br08330]
 Anti-inflammatory
  DG01504  Nonsteroidal anti-inflammatory drug (NSAID)
   DG01908  Anti-inflammatory drug, propionic acid derivatives
    D01865  Pelubiprofen
Other DBs
CAS: 69956-77-0
PubChem: 7848927
ChEBI: 31970
LigandBox: D01865
NIKKAJI: J227.578C
KCF data

ATOM        19
            1   C2y C    25.9700  -25.4800
            2   C1x C    25.9700  -24.0800
            3   C1x C    24.7800  -23.3800
            4   C1x C    23.5900  -24.0800
            5   C1x C    23.5900  -25.4800
            6   C5x C    24.7800  -26.1800
            7   O5x O    24.7800  -27.5800
            8   C2b C    27.1600  -26.1800
            9   C8y C    28.4200  -25.4800
            10  C8x C    29.6100  -26.1800
            11  C8x C    30.8000  -25.4800
            12  C8y C    30.8000  -24.0800
            13  C8x C    29.6100  -23.3800
            14  C8x C    28.4200  -24.0800
            15  C1c C    32.0600  -23.3800
            16  C6a C    33.2500  -24.0800
            17  C1a C    32.0600  -21.9800
            18  O6a O    33.2500  -25.4800
            19  O6a O    34.4400  -23.3800
BOND        20
            1     3   4 1
            2     4   5 1
            3     5   6 1
            4     6   1 1
            5     9  10 2
            6    10  11 1
            7    11  12 2
            8    12  13 1
            9    13  14 2
            10   14   9 1
            11    6   7 2
            12   12  15 1
            13    1   2 1
            14   15  16 1
            15    1   8 2
            16   15  17 1
            17    2   3 1
            18   16  18 2
            19    8   9 1
            20   16  19 1

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