KEGG   DRUG: Bromindione
Entry
D03164                      Drug                                   

Name
Bromindione (USAN/INN)
Formula
C15H9BrO2
Exact mass
299.9786
Mol weight
301.1348
Structure
Simcomp
Class
Cardiovascular agent
 DG01708  Coumarin anticoagulant
  DG01761  Phenindion type coumarin derivative
 DG01950  Antithrombotic agent
  DG01708  Coumarin anticoagulant
   DG01761  Phenindion type coumarin derivative
Efficacy
Anticoagulant, Vitamin K antagonist
Comment
Phenindione (indandione) derivative
Interaction
Other DBs
CAS: 1146-98-1
PubChem: 17397318
ChEMBL: CHEMBL288496
LigandBox: D03164
NIKKAJI: J7.281H
LinkDB
KCF data

ATOM        18
            1   C1y C    33.5169  -18.6203
            2   C8y C    34.9146  -18.6319
            3   C5x C    32.6840  -19.7444
            4   C5x C    32.7073  -17.4789
            5   C8x C    35.5960  -19.8607
            6   C8x C    35.6251  -17.4323
            7   C8y C    31.3562  -19.2901
            8   O5x O    33.0976  -21.0780
            9   C8y C    31.3737  -17.8923
            10  O5x O    33.1559  -16.1512
            11  C8x C    36.9996  -19.8724
            12  C8x C    37.0228  -17.4497
            13  C8x C    30.1390  -19.9773
            14  C8x C    30.1682  -17.1818
            15  C8y C    37.7101  -18.6669
            16  C8x C    28.9336  -19.2668
            17  C8x C    28.8751  -17.8634
            18  X   Br   39.1209  -18.6799
BOND        20
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 2
            8     4   9 1
            9     4  10 2
            10    5  11 1
            11    6  12 2
            12    7  13 1
            13    9  14 1
            14   11  15 2
            15   13  16 2
            16   14  17 2
            17    7   9 2
            18   12  15 1
            19   16  17 1
            20   15  18 1

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