KEGG   COMPOUND: C22681
Entry
C22681                      Compound                               
Name
Andrimid
Formula
C27H33N3O5
Exact mass
479.2420
Mol weight
479.57
Structure
Other DBs
PubChem: 497620037
LinkDB
KCF data

ATOM        35
            1   C1a C     8.5235  -17.7178
            2   C2b C     9.6997  -17.0259
            3   C2b C    10.9451  -17.7178
            4   C2b C    12.1213  -17.0259
            5   C2b C    13.2975  -17.7178
            6   C2b C    14.5429  -17.0259
            7   C2b C    15.7191  -17.7178
            8   C5a C    16.8954  -17.0259
            9   N1b N    18.0716  -17.7178
            10  O5a O    16.8954  -15.6421
            11  C1c C    19.2478  -17.0259
            12  C1b C    20.4240  -17.7178
            13  C8y C    19.2478  -15.6421
            14  C5a C    21.6002  -17.0259
            15  N1b N    22.7764  -17.7178
            16  O5a O    21.6002  -15.6421
            17  C1c C    23.9526  -17.0259
            18  C5a C    25.1289  -17.7178
            19  C1c C    23.9526  -15.6421
            20  C1a C    22.7764  -14.9503
            21  C1y C    26.5818  -17.0259
            22  O5a O    25.1289  -19.1016
            23  C5x C    27.8272  -17.5794
            24  N1x N    28.7959  -16.5416
            25  C5x C    28.1040  -15.3654
            26  C1y C    26.7202  -15.6421
            27  O5x O    28.1732  -18.8940
            28  O5x O    28.6575  -14.0508
            29  C1a C    26.4434  -13.7048
            30  C8x C    20.4240  -14.9503
            31  C8x C    20.4240  -13.5665
            32  C8x C    19.2478  -12.8746
            33  C8x C    18.0716  -13.5665
            34  C8x C    18.0716  -14.9503
            35  C1a C    25.1289  -14.9503
BOND        36
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     6   7 2
            7     7   8 1
            8     8   9 1
            9     8  10 2
            10   11   9 1 #Down
            11   11  12 1
            12   11  13 1
            13   12  14 1
            14   14  15 1
            15   14  16 2
            16   17  15 1 #Up
            17   17  18 1
            18   17  19 1
            19   19  20 1
            20   21  18 1 #Up
            21   18  22 2
            22   21  23 1
            23   23  24 1
            24   24  25 1
            25   25  26 1
            26   21  26 1
            27   23  27 2
            28   25  28 2
            29   26  29 1 #Down
            30   13  30 2
            31   30  31 1
            32   31  32 2
            33   32  33 1
            34   33  34 2
            35   13  34 1
            36   19  35 1

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