KEGG   DRUG: Mebrofenin
Entry
D04869                      Drug                                   

Name
Mebrofenin (USP/INN)
Product
Formula
C15H19BrN2O5
Exact mass
386.0477
Mol weight
387.2258
Structure
Simcomp
Remark
Product: D04869<US>
Efficacy
Diagnostic aid (hepatobiliary function determination)
Comment
Component of Choletec (TN)
Methyliminodiacetic acid derivative
Other DBs
CAS: 78266-06-5
PubChem: 47206640
ChEMBL: CHEMBL1605443
LigandBox: D04869
NIKKAJI: J32.494I
LinkDB
KCF data

ATOM        23
            1   C8y C    20.8600  -16.2400
            2   C8y C    20.8600  -17.6400
            3   C8x C    22.0500  -18.3400
            4   C8y C    23.3100  -17.6400
            5   C8y C    23.3100  -16.2400
            6   C8y C    22.0500  -15.5400
            7   C1a C    22.0500  -14.1400
            8   C1a C    19.6700  -18.3400
            9   N1b N    24.5000  -15.5400
            10  X   Br   19.6700  -15.5400
            11  C5a C    25.6900  -16.2400
            12  C1a C    24.5000  -18.3400
            13  C1b C    26.8800  -15.5400
            14  O5a O    25.6900  -17.6400
            15  N1c N    28.0700  -16.2400
            16  C1b C    29.2600  -15.5400
            17  C1b C    28.0700  -17.6400
            18  C6a C    29.2486  -14.1400
            19  C6a C    29.2824  -18.3400
            20  O6a O    28.0392  -13.4548
            21  O6a O    30.4638  -13.4252
            22  O6a O    30.4779  -17.6496
            23  O6a O    29.2825  -19.7398
BOND        23
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     6   7 1
            8     2   8 1
            9     5   9 1
            10    1  10 1
            11    9  11 1
            12    4  12 1
            13   11  13 1
            14   11  14 2
            15   13  15 1
            16   15  16 1
            17   15  17 1
            18   16  18 1
            19   17  19 1
            20   18  20 2
            21   18  21 1
            22   19  22 1
            23   19  23 2

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