KEGG   COMPOUND: C18845Help
Entry
C18845                      Compound                               

Name
Mycinamicin I
Formula
C37H61NO12
Exact mass
711.4194
Mol weight
711.8797
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map01130  Biosynthesis of antibiotics
Enzyme
1.14.13.-
Other DBs
CAS: 73665-15-3
PubChem: 124489519
ChEBI: 82006
KNApSAcK: C00018281
KCF data Show

ATOM        50
            1   C1y C    24.3326  -19.2066
            2   C1y C    24.3326  -20.6080
            3   C1y C    25.5239  -21.3087
            4   O7x O    26.7851  -20.6080
            5   C1y C    25.5239  -18.5059
            6   C2x C    26.7851  -16.4039
            7   C2x C    25.5239  -17.1046
            8   C1y C    29.1675  -16.4039
            9   C1x C    29.1675  -15.0025
            10  C1y C    27.9763  -14.3018
            11  C5x C    26.7851  -15.0025
            12  C2x C    29.1675  -19.2066
            13  C1y C    30.4287  -18.5059
            14  C1y C    30.4287  -17.1046
            15  C7x C    27.9763  -21.3087
            16  C2x C    29.1675  -20.6080
            17  O5x O    25.5939  -14.3018
            18  O2x O    24.3326  -17.8052
            19  C1b C    25.5239  -22.7101
            20  C1a C    24.3326  -23.4108
            21  O6a O    27.9763  -22.7101
            22  C1a C    31.6199  -19.2066
            23  C1a C    27.9763  -17.1046
            24  C1a C    27.9763  -12.9004
            25  C1b C    23.1414  -21.3087
            26  O2a O    21.9503  -20.6080
            27  C1y C    20.7591  -21.3087
            28  C1y C    18.3067  -21.3087
            29  C1y C    18.3067  -22.7101
            30  C1y C    19.4979  -23.4108
            31  C1y C    20.7591  -22.7101
            32  O2x O    19.4979  -20.6080
            33  C1a C    17.1155  -20.6080
            34  O1a O    17.1155  -23.4108
            35  O2a O    19.4979  -24.8121
            36  O2a O    22.0204  -23.4108
            37  C1a C    22.0204  -24.8121
            38  C1a C    18.3067  -25.5129
            39  O2a O    31.6199  -16.4039
            40  C1y C    33.0213  -16.4039
            41  C1y C    33.7220  -17.5951
            42  C1y C    35.1234  -17.5951
            43  C1x C    35.8240  -16.4039
            44  C1y C    35.1234  -15.1426
            45  O2x O    33.7220  -15.1426
            46  C1a C    35.8341  -13.9348
            47  N1c N    35.8191  -18.8116
            48  O1a O    33.0262  -18.8116
            49  C1a C    37.2252  -18.8174
            50  C1a C    35.1256  -20.0011
BOND        53
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     1   5 1
            5     6   7 2
            6     5   7 1
            7     8   9 1
            8     9  10 1
            9    10  11 1
            10    6  11 1
            11   12  13 1
            12   13  14 1
            13   14   8 1
            14    4  15 1
            15   15  16 1
            16   12  16 2
            17   11  17 2
            18    1  18 1 #Up
            19    5  18 1 #Up
            20    3  19 1 #Down
            21   19  20 1
            22   15  21 2
            23   13  22 1 #Up
            24    8  23 1 #Up
            25   10  24 1 #Down
            26    2  25 1 #Up
            27   25  26 1
            28   27  26 1 #Up
            29   28  29 1
            30   29  30 1
            31   30  31 1
            32   31  27 1
            33   27  32 1
            34   28  32 1
            35   28  33 1 #Up
            36   29  34 1 #Down
            37   30  35 1 #Down
            38   31  36 1 #Down
            39   36  37 1
            40   35  38 1
            41   14  39 1 #Down
            42   40  39 1 #Down
            43   41  42 1
            44   42  43 1
            45   43  44 1
            46   44  45 1
            47   45  40 1
            48   41  40 1
            49   44  46 1 #Down
            50   42  47 1 #Down
            51   41  48 1 #Up
            52   47  49 1
            53   47  50 1

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