KEGG   COMPOUND: C22674
Entry
C22674                      Compound                               
Name
Aucubinine B
Formula
C9H9NO
Exact mass
147.0684
Mol weight
147.1739
Structure
Brite
Dietary phytochemicals [br08012.html]
 Other phytochemicals
  C22674
LinkDB
KCF data

ATOM        11
            1   C1a C    16.7324  -18.1327
            2   C1y C    17.9226  -17.4325
            3   C8y C    19.3228  -17.0125
            4   C8x C    20.5130  -17.7126
            5   C8y C    19.3228  -15.6123
            6   N5x N    21.7032  -17.0125
            7   C5x C    17.9226  -15.1922
            8   C8x C    20.5130  -14.9122
            9   C1x C    17.0825  -16.3124
            10  C8x C    21.7032  -15.6123
            11  O5x O    17.5026  -13.8620
BOND        12
            1     1   2 1
            2     3   4 1
            3     3   5 2
            4     3   2 1
            5     4   6 2
            6     5   7 1
            7     5   8 1
            8     2   9 1
            9     6  10 1
            10    7  11 2
            11    7   9 1
            12    8  10 2

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