KEGG   COMPOUND: C12322Help
Entry
C12322                      Compound                               

Name
dTDP-L-vancosamine;
dTDP-beta-L-vancosamine
Formula
C17H29N3O13P2
Exact mass
545.1176
Mol weight
545.372
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map01055  Biosynthesis of vancomycin group antibiotics
map01100  Metabolic pathways
map01130  Biosynthesis of antibiotics
Enzyme
Other DBs
PubChem: 582712
ChEBI: 32336
3DMET: B05631
NIKKAJI: J2.781.745I
KCF data Show

ATOM        35
            1   N4y N    28.7386  -15.2173
            2   C8y C    27.5498  -14.5121
            3   C8x C    29.9447  -14.5121
            4   N4x N    27.5498  -13.1254
            5   O5x O    26.3613  -15.1940
            6   C8y C    29.9447  -13.1254
            7   C8y C    28.7386  -12.4321
            8   C1a C    31.1216  -12.4321
            9   O5x O    28.7386  -11.0686
            10  C1y C    28.1661  -16.8066
            11  O2x O    27.0786  -16.0130
            12  C1x C    27.7545  -18.1875
            13  C1y C    25.9294  -16.8533
            14  C1y C    26.3489  -18.1875
            15  C1b C    24.5938  -16.4150
            16  O1a O    25.5215  -19.3134
            17  O2b O    23.5497  -17.3543
            18  P1b P    22.1501  -17.3543
            19  O2c O    20.7503  -17.3543
            20  O1c O    22.1442  -18.7541
            21  O1c O    22.1442  -15.9547
            22  P1b P    19.3450  -17.3543
            23  O2b O    17.9453  -17.3543
            24  O1c O    19.3392  -18.7541
            25  O1c O    19.3392  -15.9547
            26  C1y C    16.7554  -18.0361
            27  C1x C    16.7438  -19.4183
            28  O2x O    15.5657  -17.3485
            29  C1z C    15.5424  -20.1069
            30  C1y C    14.3712  -18.0185
            31  C1y C    14.3595  -19.4007
            32  N1a N    16.6853  -21.2532
            33  C1a C    13.1870  -17.3369
            34  O1a O    13.1406  -20.0895
            35  C1a C    14.9227  -21.1789
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 #Down
            34   13  14 1
            35   30  31 1
            36    2   4 1
            37   29  35 1 #Up

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