KEGG   DRUG: BetiatideHelp
Entry
D03105                      Drug                                   

Name
Betiatide (USAN)
Product
Formula
C15H17N3O6S
Exact mass
367.0838
Mol weight
367.377
Structure
Mol fileKCF fileDB search
Remark
Product: D03105<US>
Efficacy
Diagnostic aid
Other DBs
CAS: 103725-47-9
PubChem: 17397260
ChEMBL: CHEMBL3183117
LigandBox: D03105
LinkDB All DBs
KCF data Show

ATOM        25
            1   C8x C    33.2500  -16.7300
            2   C8x C    33.2500  -18.1300
            3   C8x C    32.0600  -18.8300
            4   C8x C    30.8000  -18.1300
            5   C8y C    30.8000  -16.7300
            6   C8x C    32.0600  -16.0300
            7   C5a C    29.6100  -16.0300
            8   S2a S    28.4200  -16.7300
            9   O5a O    29.6100  -14.6300
            10  C1b C    27.2300  -16.0300
            11  C5a C    26.0400  -16.7300
            12  N1b N    24.8500  -16.0300
            13  C1b C    23.6600  -16.7300
            14  C5a C    22.4700  -16.0300
            15  N1b N    21.2100  -16.7300
            16  C1b C    20.0200  -16.0300
            17  C5a C    18.8300  -16.7300
            18  N1b N    17.5700  -16.0300
            19  C1b C    16.3800  -16.7300
            20  C6a C    15.1900  -16.0300
            21  O6a O    13.9300  -16.7300
            22  O5a O    26.0400  -18.1300
            23  O5a O    22.4700  -14.6300
            24  O5a O    18.8300  -18.1300
            25  O6a O    15.1900  -14.6300
BOND        25
            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     5   7 1
            8     7   8 1
            9     7   9 2
            10    8  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   16  17 1
            18   17  18 1
            19   18  19 1
            20   19  20 1
            21   20  21 1
            22   11  22 2
            23   14  23 2
            24   17  24 2
            25   20  25 2

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