KEGG   COMPOUND: C11709
Entry
C11709                      Compound                               
Name
DU 122290
Formula
C19H26N2O3S
Exact mass
362.1664
Mol weight
362.4863
Structure
Other DBs
PubChem: 13874
ChEBI: 4303
NIKKAJI: J499.700J
LinkDB
KCF data

ATOM        25
            1   C8x C    20.5100  -23.3100
            2   C8y C    20.5100  -24.7100
            3   C8x C    21.7224  -25.4100
            4   C8y C    22.9349  -24.7100
            5   C8y C    22.9349  -23.3100
            6   C8x C    21.7224  -22.6100
            7   S4a S    19.2976  -25.4100
            8   C1b C    18.0851  -26.1100
            9   O3c O    18.6034  -24.2073
            10  O3c O    20.0030  -26.6321
            11  C1a C    16.8540  -25.3990
            12  C8y C    24.1660  -25.4210
            13  O2a O    24.1660  -22.5990
            14  C8x C    24.5996  -26.7359
            15  C8x C    25.9869  -26.7328
            16  C8y C    26.4127  -25.4125
            17  N4x N    25.2885  -24.5995
            18  C1y C    27.7234  -24.9832
            19  C1x C    28.8589  -25.8042
            20  C1x C    29.9906  -24.9780
            21  C1x C    29.5545  -23.6464
            22  N1y N    28.1533  -23.6496
            23  C1b C    27.3282  -22.5194
            24  C1a C    24.1660  -21.1990
            25  C1a C    27.6905  -21.1671
BOND        27
            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     2   7 1
            8     7   8 1
            9     7   9 2
            10    7  10 2
            11    8  11 1
            12    4  12 1
            13    5  13 1
            14   12  14 2
            15   14  15 1
            16   15  16 2
            17   16  17 1
            18   12  17 1
            19   16  18 1
            20   18  19 1
            21   19  20 1
            22   20  21 1
            23   21  22 1
            24   18  22 1
            25   22  23 1
            26   13  24 1
            27   23  25 1

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