KEGG   COMPOUND: C21266Help
Entry
C21266                      Compound                               

Name
3''-Amino-3''-deoxygentamicin A2;
3''-Demethyl-gentamicin A
Formula
C17H34N4O10
Exact mass
454.2275
Mol weight
454.4727
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00524  Neomycin, kanamycin and gentamicin biosynthesis
map01130  Biosynthesis of antibiotics
Enzyme
2.1.1.-         2.6.1.-
Other DBs
PubChem: 315661365
PDB-CCD: 7XP[PDBj]
KCF data Show

ATOM        31
            1   C1x C    13.7780  -18.9474
            2   C1y C    13.7780  -20.3460
            3   C1y C    14.9892  -21.0453
            4   C1y C    16.2004  -20.3460
            5   C1y C    16.2004  -18.9474
            6   O2x O    14.9892  -18.2481
            7   O2a O    17.4303  -18.2372
            8   C1y C    18.6416  -17.5379
            9   C1y C    19.8812  -18.2536
            10  C1x C    21.0924  -17.5545
            11  C1y C    21.0926  -16.1557
            12  C1y C    19.8531  -15.4401
            13  C1y C    18.6418  -16.1391
            14  O1a O    17.4303  -21.0563
            15  N1a N    14.9892  -22.4439
            16  N1a N    19.9510  -19.6466
            17  O1a O    17.4589  -15.4560
            18  N1a N    22.3273  -15.4430
            19  O2a O    19.8533  -14.0523
            20  C1y C    21.0711  -13.3495
            21  O2x O    22.2685  -14.0411
            22  C1y C    23.4798  -13.3422
            23  C1y C    23.4801  -11.9435
            24  C1y C    22.2829  -11.2518
            25  C1y C    21.0714  -11.9507
            26  C1b C    24.7095  -14.0524
            27  N1a N    19.8466  -11.2431
            28  O1a O    12.5984  -21.0266
            29  O1a O    22.2832   -9.8763
            30  O1a O    24.6707  -11.2570
            31  O1a O    24.7089  -15.4795
BOND        33
            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    3  15 1 #Up
            17    9  16 1 #Up
            18   13  17 1 #Up
            19   11  18 1 #Up
            20   12  19 1 #Down
            21   20  19 1 #Down
            22   20  21 1
            23   21  22 1
            24   22  23 1
            25   23  24 1
            26   24  25 1
            27   20  25 1
            28   22  26 1 #Up
            29   25  27 1 #Down
            30    2  28 1 #Down
            31   24  29 1 #Up
            32   23  30 1 #Down
            33   26  31 1

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