KEGG   COMPOUND: C17069
Entry
C17069                      Compound                               
Name
Sophoranol;
5-Hydroxymatrine
Formula
C15H24N2O2
Exact mass
264.1838
Mol weight
264.3633
Structure
Other DBs
CAS: 3411-37-8
PubChem: 96023547
ChEBI: 80905
KNApSAcK: C00007761
NIKKAJI: J359.362B
LinkDB
KCF data

ATOM        19
            1   C1x C    22.9302  -15.5473
            2   C1x C    22.9302  -16.9492
            3   C1x C    24.1482  -17.6537
            4   N1y N    25.3531  -16.9492
            5   C1x C    26.5652  -17.6588
            6   C1x C    27.7833  -16.9595
            7   C1x C    27.7892  -15.5576
            8   C1z C    24.1482  -14.8499
            9   C1y C    25.3562  -15.5524
            10  C1y C    26.5720  -14.8638
            11  C1x C    24.1562  -13.4514
            12  N1y N    25.3721  -12.7559
            13  C1y C    26.5765  -13.4640
            14  C1x C    27.7895  -12.7708
            15  C1x C    27.7980  -11.3762
            16  C1x C    26.5936  -10.6749
            17  C5x C    25.3107  -11.3611
            18  O5x O    24.1560  -10.6582
            19  O1a O    22.9356  -14.1499
BOND        22
            1     9  10 1
            2    10  13 1
            3    12  11 1
            4    11   8 1
            5     3   4 1
            6     9   4 1
            7     4   5 1
            8     5   6 1
            9     6   7 1
            10    7  10 1
            11   12  13 1
            12   13  14 1
            13   14  15 1
            14   15  16 1
            15   16  17 1
            16   17  12 1
            17    8   1 1
            18   17  18 2
            19    1   2 1
            20    2   3 1
            21    8   9 1
            22    8  19 1 #Down

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