KEGG   COMPOUND: C17387Help
Entry
C17387                      Compound                               

Name
Cycleanine
Formula
C38H42N2O6
Exact mass
622.3043
Mol weight
622.7499
Structure
Mol fileKCF fileDB searchJmolKegDraw
Other DBs
CAS: 
518-94-5
PubChem: 
ChEBI: 
KNApSAcK: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        46
            1   C8x C    28.9707  -26.0552
            2   C8y C    28.2586  -27.2605
            3   C8x C    28.9464  -28.4799
            4   C8x C    30.3463  -28.4940
            5   C8y C    31.0584  -27.2886
            6   C8x C    30.3706  -26.0692
            7   C1x C    23.8000  -22.8900
            8   C1x C    23.1000  -24.0800
            9   C8y C    23.8000  -25.3400
            10  C8y C    25.2000  -25.3400
            11  C1y C    25.9000  -24.0800
            12  N1y N    25.2000  -22.8900
            13  C8x C    23.1700  -26.5300
            14  C8y C    23.8700  -27.7200
            15  C8y C    25.2700  -27.7200
            16  C8y C    25.9700  -26.5300
            17  C1x C    27.0900  -23.3800
            18  C8y C    28.2800  -23.3800
            19  C8x C    28.9800  -24.6400
            20  C8x C    30.3800  -24.6400
            21  C8y C    31.0800  -23.4500
            22  C8x C    30.3800  -22.1900
            23  C8x C    28.9800  -22.1900
            24  O2x O    32.2700  -23.4500
            25  C8y C    33.4600  -24.1500
            26  C8y C    34.1600  -25.3400
            27  C8y C    35.5600  -25.3400
            28  C8x C    36.2600  -24.0800
            29  C8y C    35.5600  -22.8900
            30  C8y C    34.1600  -22.8900
            31  C1y C    33.4600  -26.5300
            32  N1y N    34.2300  -27.7900
            33  C1x C    35.6300  -27.7900
            34  C1x C    36.2600  -26.5300
            35  O2x O    27.1600  -27.2300
            36  C1x C    32.2700  -27.3000
            37  C1a C    33.5452  -29.0111
            38  C1a C    25.8951  -21.6747
            39  O2a O    36.2551  -21.6747
            40  O2a O    33.4500  -21.6834
            41  O2a O    25.9651  -28.9353
            42  O2a O    23.1749  -28.9353
            43  C1a C    25.2722  -30.1237
            44  C1a C    23.8678  -30.1237
            45  C1a C    35.5622  -20.4863
            46  C1a C    34.1353  -20.4736
BOND        52
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     7   8 1
            8     8   9 1
            9     9  10 2
            10   10  11 1
            11   11  12 1
            12    7  12 1
            13    9  13 1
            14   13  14 2
            15   14  15 1
            16   15  16 2
            17   10  16 1
            18   17  18 1
            19   17  11 1
            20   18  19 1
            21   19  20 2
            22   20  21 1
            23   21  22 2
            24   22  23 1
            25   18  23 2
            26   24  25 1
            27   24  21 1
            28   25  26 1
            29   26  27 2
            30   27  28 1
            31   28  29 2
            32   29  30 1
            33   25  30 2
            34   26  31 1
            35   31  32 1
            36   32  33 1
            37   33  34 1
            38   27  34 1
            39   16  35 1
            40   36  31 1
            41    2  35 1
            42    5  36 1
            43   32  37 1
            44   12  38 1
            45   29  39 1
            46   30  40 1
            47   15  41 1
            48   14  42 1
            49   41  43 1
            50   42  44 1
            51   39  45 1
            52   40  46 1

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