KEGG   DRUG: Sprodiamide
Entry
D05913                      Drug                                   
Name
Sprodiamide (USAN/INN)
Formula
C16H26N5O8. Dy
Exact mass
580.1073
Mol weight
578.91
Structure
Simcomp
Efficacy
Diagnostic aid (paramagnetic)
Other DBs
CAS: 128470-17-7
PubChem: 47207571
LigandBox: D05913
LinkDB
KCF data

ATOM        30
            1   C6a C    26.0947  -25.3475
            2   O6a O    24.9784  -25.9918 #-
            3   O6a O    26.0950  -24.0676
            4   C1b C    27.3837  -25.3475
            5   O6a O    23.8775  -27.9344 #-
            6   C6a C    23.8775  -29.2234
            7   C1b C    24.5220  -30.3397
            8   C1b C    26.1101  -31.8014
            9   N1c N    27.2264  -31.1569
            10  O5a O    24.9939  -29.8679
            11  C5a C    24.9939  -31.1569
            12  C1b C    28.3427  -31.8014
            13  C1b C    29.4590  -31.1569
            14  N1c N    29.4590  -29.8679
            15  C1b C    30.5752  -29.2234
            16  C1b C    30.5752  -27.9344
            17  N1c N    29.4590  -27.2900
            18  C1b C    29.4590  -26.0010
            19  C5a C    28.3427  -25.3565
            20  O5a O    27.2264  -26.0010
            21  O6a O    22.6109  -29.5629
            22  N1b N    23.8776  -31.8014
            23  C1b C    30.5752  -30.5124
            24  C6a C    31.6778  -29.8757
            25  O6a O    32.7719  -30.5073
            26  O6a O    31.6779  -28.5792 #-
            27  N1b N    28.3427  -24.0677
            28  C1a C    29.4763  -23.4130
            29  C1a C    22.7440  -31.1468
            30  Z   Dy   26.6901  -28.3856 #3+
BOND        28
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     5   6 1
            5     6   7 1
            6     8   9 1
            7    10  11 2
            8     8  11 1
            9     9  12 1
            10   12  13 1
            11   13  14 1
            12   14  15 1
            13   15  16 1
            14   16  17 1
            15   17  18 1
            16   18  19 1
            17   19  20 2
            18    7   9 1
            19    6  21 2
            20   11  22 1
            21   14  23 1
            22   23  24 1
            23   24  25 2
            24   24  26 1
            25    4  17 1
            26   19  27 1
            27   27  28 1
            28   22  29 1

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