KEGG   COMPOUND: C09222
Entry
C09222                      Compound                               
Name
Melosatin B
Formula
C19H19NO2
Exact mass
293.1416
Mol weight
293.3597
Structure
Other DBs
CAS: 64838-03-5
PubChem: 11413
ChEBI: 6740
KNApSAcK: C00001747
3DMET: B02778
NIKKAJI: J19.532D
LinkDB
KCF data

ATOM        22
            1   C8y C    31.0133  -20.8940
            2   C8y C    31.0092  -22.2521
            3   C8x C    23.9541  -16.8240
            4   C8x C    22.7720  -16.1414
            5   C8x C    21.5917  -16.8272
            6   C8x C    21.5935  -18.1884
            7   C8y C    23.9560  -18.1852
            8   C8x C    22.7651  -18.8575
            9   C1b C    29.8245  -18.8607
            10  C1b C    28.6495  -18.1852
            11  C1b C    27.4744  -18.8607
            12  C1b C    26.2992  -18.1852
            13  C1b C    25.1312  -18.8607
            14  C8x C    28.6566  -20.9014
            15  C8x C    28.6566  -22.2594
            16  C8x C    29.8379  -22.9420
            17  C8y C    29.8379  -20.2188
            18  N1x N    32.2996  -22.6757
            19  C5x C    33.1012  -21.5793
            20  C5x C    32.3062  -20.4782
            21  O5x O    34.5098  -21.5836
            22  O5x O    32.7370  -19.1675
BOND        24
            1     8   7 1
            2     9  10 1
            3     1   2 2
            4    10  11 1
            5    11  12 1
            6    12  13 1
            7    13   7 1
            8     3   4 1
            9     4   5 2
            10    5   6 1
            11    7   3 2
            12   14  15 1
            13   15  16 2
            14   16   2 1
            15    1  17 1
            16   17  14 2
            17   17   9 1
            18    6   8 2
            19    2  18 1
            20   18  19 1
            21   19  20 1
            22    1  20 1
            23   19  21 2
            24   20  22 2

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