KEGG   COMPOUND: C21269Help
Entry
C21269                      Compound                               

Name
Antibiotic JI-20Ba;
JI-20Ba
Formula
C20H41N5O9
Exact mass
495.2904
Mol weight
495.5676
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00524  Neomycin, kanamycin and gentamicin biosynthesis
map01130  Biosynthesis of antibiotics
Enzyme
2.6.1.-
Other DBs
PubChem: 315661368
ChEMBL: CHEMBL3245228
KCF data Show

ATOM        34
            1   C1x C    13.2723  -18.6519
            2   C1z C    13.2723  -20.0494
            3   C1y C    14.4825  -20.7482
            4   C1y C    15.6928  -20.0494
            5   C1y C    15.6928  -18.6519
            6   O2x O    14.4825  -17.9532
            7   O2a O    16.9217  -17.9422
            8   C1y C    18.1319  -17.2435
            9   C1y C    19.3705  -17.9587
            10  C1x C    20.5808  -17.2601
            11  C1y C    20.5810  -15.8626
            12  C1y C    19.3425  -15.1475
            13  C1y C    18.1321  -15.8460
            14  O1a O    16.9217  -20.7592
            15  C1a C    12.9106  -21.3992
            16  O1a O    11.8748  -20.0494
            17  N1b N    14.4825  -22.1455
            18  C1a C    13.2555  -22.8540
            19  N1a N    19.3703  -19.3505
            20  O1a O    16.9503  -15.1634
            21  N1a N    21.8147  -15.1504
            22  O2a O    19.3427  -13.7609
            23  C1y C    20.5596  -13.0585
            24  O2x O    21.7559  -13.7497
            25  C1y C    22.9663  -13.0512
            26  C1y C    22.9666  -11.6538
            27  C1y C    21.7703  -10.9626
            28  C1y C    20.5599  -11.6610
            29  C1c C    24.1950  -13.7610
            30  C1a C    25.3886  -13.0721
            31  N1a N    24.1947  -15.1581
            32  N1a N    19.3360  -10.9539
            33  O1a O    21.7709   -9.5925
            34  O1a O    24.1931  -10.9464
BOND        36
            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     5   7 1 #Down
            8     8   7 1 #Down
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14    8  13 1
            15    4  14 1 #Down
            16    2  15 1 #Down
            17    2  16 1 #Up
            18    3  17 1 #Up
            19   17  18 1
            20    9  19 1 #Up
            21   13  20 1 #Up
            22   11  21 1 #Up
            23   12  22 1 #Down
            24   23  22 1 #Down
            25   23  24 1
            26   24  25 1
            27   25  26 1
            28   26  27 1
            29   27  28 1
            30   23  28 1
            31   25  29 1
            32   29  30 1 #Down
            33   29  31 1
            34   28  32 1 #Down
            35   27  33 1 #Up
            36   26  34 1 #Down

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