KEGG   COMPOUND: C12321
Entry
C12321                      Compound                               

Name
dTDP-L-epivancosamine;
dTDP-beta-L-4-epi-vancosamine;
dTDP-3-amino-2,3,6-trideoxy-3-methyl-beta-L-arabino-hexopyranose
Formula
C17H29N3O13P2
Exact mass
545.1176
Mol weight
545.372
Structure
Reaction
Pathway
map01055  Biosynthesis of vancomycin group antibiotics
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Enzyme
Other DBs
PubChem: 582711
ChEBI: 76056
3DMET: B05630
NIKKAJI: J1.464.415F
KCF data

ATOM        35
            1   N4y N    28.7349  -15.2270
            2   C8y C    27.5462  -14.5219
            3   C8x C    29.9411  -14.5219
            4   N4x N    27.5462  -13.1351
            5   O5x O    26.3576  -15.2037
            6   C8y C    29.9411  -13.1351
            7   C8y C    28.7349  -12.4418
            8   C1a C    31.1180  -12.4418
            9   O5x O    28.7349  -11.0784
            10  C1y C    28.1624  -16.8164
            11  O2x O    27.0748  -16.0227
            12  C1x C    27.7507  -18.1973
            13  C1y C    25.9257  -16.8631
            14  C1y C    26.3453  -18.1973
            15  C1b C    24.5902  -16.4247
            16  O1a O    25.5178  -19.3232
            17  O2b O    23.5459  -17.3641
            18  P1b P    22.1464  -17.3641
            19  O2c O    20.7467  -17.3641
            20  O1c O    22.1405  -18.7638
            21  O1c O    22.1405  -15.9644
            22  P1b P    19.3411  -17.3641
            23  O2b O    17.9417  -17.3641
            24  O1c O    19.3354  -18.7638
            25  O1c O    19.3354  -15.9644
            26  C1y C    16.7518  -18.0459
            27  C1x C    16.7401  -19.4281
            28  O2x O    15.5618  -17.3583
            29  C1z C    15.5385  -20.1167
            30  C1y C    14.3673  -18.0283
            31  C1y C    14.3557  -19.4105
            32  N1a N    16.6816  -21.2630
            33  C1a C    13.1833  -17.3467
            34  O1a O    13.1369  -20.0993
            35  C1a C    14.9191  -21.1886
BOND        37
            1     2   5 2
            2     3   6 2
            3     4   7 1
            4     6   8 1
            5     7   9 2
            6     6   7 1
            7    10   1 1 #Up
            8     1   2 1
            9     1   3 1
            10   10  11 1
            11   10  12 1
            12   11  13 1
            13   12  14 1
            14   13  15 1 #Up
            15   14  16 1 #Down
            16   15  17 1
            17   17  18 1
            18   18  19 1
            19   18  20 1
            20   18  21 2
            21   19  22 1
            22   22  23 1
            23   22  24 1
            24   22  25 2
            25   26  23 1 #Down
            26   26  27 1
            27   26  28 1
            28   27  29 1
            29   28  30 1
            30   29  31 1
            31   29  32 1 #Down
            32   30  33 1 #Down
            33   31  34 1 #Up
            34   13  14 1
            35   30  31 1
            36    2   4 1
            37   29  35 1 #Up

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