KEGG   COMPOUND: C17980
Entry
C17980                      Compound                               
Name
1-Epidactimicin
Formula
C18H36N6O6
Exact mass
432.2696
Mol weight
432.515
Structure
Other DBs
CAS: 103531-05-1
PubChem: 96024200
ChEBI: 81431
KNApSAcK: C00017677
NIKKAJI: J247.932J
LinkDB
KCF data

ATOM        30
            1   N1c N    26.1113  -20.6383
            2   C1y C    27.3208  -19.9400
            3   C1y C    28.5585  -20.6548
            4   C1y C    29.7682  -19.9564
            5   C1y C    29.7684  -18.5597
            6   C1y C    28.5306  -17.8451
            7   C1y C    27.3210  -18.5433
            8   O2a O    28.5583  -22.0457
            9   O1a O    26.1397  -17.8608
            10  N1a N    31.0011  -17.8480
            11  O2a O    28.5308  -16.4594
            12  C1y C    29.7469  -15.7574
            13  O2x O    30.9425  -16.4482
            14  C1y C    32.1521  -15.7502
            15  C1x C    32.1524  -14.3534
            16  C1x C    30.9568  -13.6628
            17  C1y C    29.7472  -14.3606
            18  C1c C    33.3800  -16.4595
            19  N1a N    28.5241  -13.6540
            20  N1a N    33.3794  -17.8844
            21  C5a C    24.8879  -19.9324
            22  C1b C    23.6650  -20.6392
            23  N1b N    22.4403  -19.9333
            24  C1a C    26.1114  -22.0031
            25  C1a C    29.7828  -22.7528
            26  O5a O    24.8880  -18.5778
            27  C1a C    34.5927  -15.7599
            28  O1a O    30.9964  -20.6662
            29  C2b C    21.2444  -20.6253
            30  N2a N    20.0189  -19.9188
BOND        31
            1     2   1 1 #Up
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     2   7 1
            8     3   8 1 #Down
            9     7   9 1 #Up
            10    5  10 1 #Down
            11    6  11 1 #Down
            12   12  11 1 #Down
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   16  17 1
            18   12  17 1
            19   14  18 1
            20   17  19 1 #Down
            21   18  20 1
            22    1  21 1
            23   21  22 1
            24   22  23 1
            25    1  24 1
            26    8  25 1
            27   21  26 2
            28   18  27 1 #Down
            29    4  28 1 #Down
            30   23  29 1
            31   29  30 2

» Japanese version

DBGET integrated database retrieval system