KEGG   COMPOUND: C09597
Entry
C09597                      Compound                               
Name
Ochotensine
Formula
C21H21NO4
Exact mass
351.1471
Mol weight
351.3957
Structure
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tyrosine
   Isoquinoline alkaloids
    C09597  Ochotensine
Other DBs
CAS: 4959-88-0
PubChem: 11788
ChEBI: 7718
KNApSAcK: C00001896
3DMET: B03115
NIKKAJI: J13.681F
LinkDB
KCF data

ATOM        26
            1   C1z C    28.2526  -16.3179
            2   C8y C    27.0462  -15.6069
            3   C1x C    29.3890  -17.1454
            4   C2y C    27.1161  -17.1454
            5   N1y N    29.4764  -15.6185
            6   C8y C    27.0519  -14.2081
            7   C8x C    25.8514  -16.3120
            8   C8y C    28.9577  -18.4684
            9   C8y C    27.5589  -18.4684
            10  C1x C    29.4823  -14.2198
            11  C1a C    30.6828  -16.3236
            12  C8x C    25.8514  -13.5088
            13  C1x C    28.2700  -13.5147
            14  C8y C    24.6334  -15.6069
            15  C8y C    29.6513  -19.6864
            16  C8x C    26.8538  -19.6805
            17  C8y C    24.6334  -14.2081
            18  O2a O    23.4210  -16.3120
            19  C8y C    28.9519  -20.8928
            20  O2x O    31.0208  -19.9895
            21  C8x C    27.5532  -20.8928
            22  O1a O    23.4153  -13.5088
            23  C1a C    22.2089  -15.6069
            24  O2x O    29.8727  -21.9419
            25  C1x C    31.1607  -21.3823
            26  C2a C    25.7181  -17.1352
BOND        30
            1     1   2 1 #Down
            2     1   3 1
            3     1   4 1
            4     1   5 1 #Up
            5     2   6 2
            6     2   7 1
            7     3   8 1
            8     4   9 1
            9     5  10 1
            10    5  11 1
            11    6  12 1
            12    6  13 1
            13    7  14 2
            14    8  15 1
            15    9  16 1
            16   12  17 2
            17   14  18 1
            18   15  19 2
            19   15  20 1
            20   16  21 2
            21   17  22 1
            22   18  23 1
            23   19  24 1
            24   20  25 1
            25    8   9 2
            26   10  13 1
            27   14  17 1
            28   19  21 1
            29   24  25 1
            30    4  26 2

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