KEGG   COMPOUND: C17009Help
Entry
C17009                      Compound                               

Name
Mycalamide B
Formula
C25H43NO10
Exact mass
517.2887
Mol weight
517.6096
Structure
Mol fileKCF fileDB searchJmolKegDraw
Other DBs
CAS: 
124512-46-5
PubChem: 
ChEBI: 
ChEMBL: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        36
            1   C1y C    16.1700  -14.2800
            2   C2y C    16.1700  -15.6800
            3   C1x C    17.3600  -16.3800
            4   C1z C    18.5500  -15.6800
            5   O2x O    18.5500  -14.2800
            6   C1y C    17.3600  -13.5800
            7   C1c C    19.8100  -16.3800
            8   C5a C    21.0000  -15.6800
            9   N1b N    22.2600  -16.3800
            10  C1y C    22.2600  -17.7800
            11  O5a O    21.0000  -14.2800
            12  C1a C    17.3600  -12.1800
            13  C1a C    14.9100  -13.5800
            14  C2a C    14.9100  -16.3800
            15  O2a O    18.5500  -17.0800
            16  C1a C    17.5700  -18.0600
            17  O1a O    19.8100  -17.6400
            18  O2x O    21.0000  -18.4800
            19  C1x C    21.0000  -19.8800
            20  O2x O    22.2600  -20.5800
            21  C1y C    23.4500  -19.8800
            22  C1y C    23.4500  -18.4800
            23  C1y C    24.6400  -20.5800
            24  C1z C    25.8300  -19.8800
            25  C1y C    25.8300  -18.4800
            26  O2x O    24.6400  -17.7800
            27  C1b C    27.0900  -17.7800
            28  C1c C    28.2800  -18.4800
            29  C1b C    29.4700  -17.7800
            30  O1a O    30.7300  -18.4800
            31  C1a C    27.1600  -20.7200
            32  C1a C    25.8300  -21.4900
            33  O2a O    24.6400  -21.9800
            34  O2a O    28.2800  -19.8800
            35  C1a C    29.4700  -20.5800
            36  C1a C    23.4500  -22.6800
BOND        38
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10   10   9 1 #Down
            11    8  11 2
            12    6  12 1 #Up
            13    1  13 1 #Up
            14    2  14 2
            15    4  15 1 #Down
            16   15  16 1
            17    7  17 1 #Up
            18   10  18 1
            19   18  19 1
            20   19  20 1
            21   20  21 1
            22   21  22 1
            23   10  22 1
            24   21  23 1
            25   23  24 1
            26   24  25 1
            27   25  26 1
            28   22  26 1
            29   25  27 1
            30   27  28 1
            31   28  29 1
            32   29  30 1
            33   24  31 1
            34   24  32 1
            35   23  33 1 #Down
            36   28  34 1 #Up
            37   34  35 1
            38   33  36 1

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