KEGG   COMPOUND: C09933
Entry
C09933                      Compound                               
Name
Cantleyine
Formula
C11H13NO3
Exact mass
207.0895
Mol weight
207.2258
Structure
Other DBs
CAS: 30333-81-4
PubChem: 12119
ChEBI: 3365
KNApSAcK: C00001965
3DMET: B03391
NIKKAJI: J442.110H
LinkDB
KCF data

ATOM        15
            1   C8y C    28.1324  -19.5168
            2   C8y C    29.3431  -20.2207
            3   C8y C    26.9135  -20.2121
            4   C1x C    28.4211  -18.1485
            5   C1y C    30.3806  -19.2823
            6   C8x C    29.3377  -21.6146
            7   C8x C    26.8452  -21.6170
            8   C7a C    25.7029  -19.5082
            9   C1y C    29.8182  -17.9997
            10  C1a C    31.5862  -19.9835
            11  N5x N    28.1287  -22.3156
            12  O7a O    25.7083  -18.1141
            13  O6a O    24.4738  -20.1973
            14  O1a O    30.5070  -16.7801
            15  C1a C    26.9242  -17.4243
BOND        16
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 1
            9     5  10 1 #Down
            10    6  11 2
            11    8  12 1
            12    8  13 2
            13    9  14 1 #Down
            14   12  15 1
            15    5   9 1
            16    7  11 1

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