KEGG   COMPOUND: C13796
Entry
C13796                      Compound                               
Name
SR95531
Formula
C15H17N3O3
Exact mass
287.127
Mol weight
287.3138
Structure
Other DBs
PubChem: 854041
ChEBI: 34968
NIKKAJI: J331.170H
LinkDB
KCF data

ATOM        21
            1   C8y C    23.1665  -20.2599
            2   C8x C    24.3917  -21.0192
            3   C8x C    25.6143  -20.3370
            4   C8y C    25.6457  -18.9568
            5   C8x C    24.4205  -18.1975
            6   C8x C    23.1979  -18.8797
            7   C8y C    26.8683  -18.2746
            8   N5x N    28.0594  -18.9728
            9   N4y N    29.2820  -18.2906
            10  C8y C    29.2434  -16.9104
            11  C8x C    28.0882  -16.1511
            12  C8x C    26.8657  -16.8333
            13  C1b C    30.4731  -18.9887
            14  C1b C    31.6957  -18.3066
            15  C1b C    32.9209  -19.0658
            16  C6a C    34.1434  -18.3837
            17  O6a O    35.3345  -19.0818
            18  O2a O    21.9439  -20.9421
            19  N2a N    30.5360  -16.2282
            20  O6a O    34.1408  -16.9423
            21  C1a C    20.7528  -20.2439
BOND        22
            1     9  10 1
            2    10  11 1
            3    11  12 2
            4    12   7 1
            5     4   7 1
            6     6   1 1
            7     9  13 1
            8    13  14 1
            9     1   2 2
            10   14  15 1
            11    2   3 1
            12   15  16 1
            13    3   4 2
            14   16  17 1
            15    4   5 1
            16    1  18 1
            17    5   6 2
            18   10  19 2
            19    7   8 2
            20   16  20 2
            21    8   9 1
            22   18  21 1

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