KEGG   COMPOUND: C10603Help
Entry
C10603                      Compound                               

Name
Lunarine
Formula
C25H31N3O4
Exact mass
437.2315
Mol weight
437.5313
Structure
Mol fileKCF fileDB search
Other DBs
CAS: 24185-51-1
PubChem: 12786
ChEBI: 6566
KNApSAcK: C00002348
3DMET: B03991
NIKKAJI: J16.474G
LinkDB All DBs
KCF data Show

ATOM        32
            1   C1z C    29.9363  -21.6697
            2   C8y C    28.5360  -21.6990
            3   C1y C    30.3976  -22.9940
            4   C1x C    30.8589  -20.6069
            5   C2x C    29.6222  -20.2986
            6   C8y C    28.1343  -23.0467
            7   C8x C    27.5795  -20.6712
            8   O2x O    29.2892  -23.8455
            9   C1x C    31.7686  -23.2499
            10  C1x C    32.2359  -20.8756
            11  C2x C    30.6547  -19.3293
            12  C8x C    26.7632  -23.3608
            13  C8y C    26.2144  -20.9923
            14  C5x C    32.6841  -22.1999
            15  C5x C    30.1158  -18.0287
            16  C8x C    25.7996  -22.3342
            17  C2x C    25.5322  -19.8432
            18  O5x O    34.0506  -22.5620
            19  N1x N    31.0809  -16.8212
            20  O5x O    28.9155  -18.0923
            21  C2x C    24.1261  -19.7965
            22  C1x C    30.8540  -15.5323
            23  C5x C    23.4254  -18.5770
            24  C1x C    29.9554  -14.7427
            25  N1x N    24.1378  -17.3696
            26  O5x O    22.0076  -18.5654
            27  C1x C    28.4844  -14.8016
            28  C1x C    23.4311  -16.1445
            29  C1x C    27.6379  -16.1621
            30  C1x C    24.1436  -14.9300
            31  N1x N    26.2377  -16.1562
            32  C1x C    25.5497  -14.9357
BOND        35
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1 #Down
            5     2   6 2
            6     2   7 1
            7     3   8 1
            8     3   9 1
            9     4  10 1
            10    5  11 2
            11    6  12 1
            12    7  13 2
            13    9  14 1
            14   11  15 1
            15   12  16 2
            16   13  17 1
            17   14  18 2
            18   15  19 1
            19   15  20 2
            20   17  21 2
            21   19  22 1
            22   21  23 1
            23   22  24 1
            24   23  25 1
            25   23  26 2
            26   24  27 1
            27   25  28 1
            28   27  29 1
            29   28  30 1
            30   29  31 1
            31   30  32 1
            32    6   8 1
            33   10  14 1
            34   13  16 1
            35   31  32 1

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