KEGG   COMPOUND: C06397Help
Entry
C06397                      Compound                               

Name
ADP-D-glycero-beta-D-manno-heptose
Formula
C17H27N5O16P2
Exact mass
619.0928
Mol weight
619.3677
Structure
Mol fileKCF fileDB searchJmolKegDraw
Comment
ADP-L-glycero-beta-D-manno-heptose [CPD:C06398]
Reaction
Pathway
Lipopolysaccharide biosynthesis
Metabolic pathways
Module
M00064  
ADP-L-glycero-D-manno-heptose biosynthesis
Enzyme
2.7.7.70        5.1.3.20
Other DBs
PubChem: 
ChEBI: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        40
            1   N4y N    32.6869  -19.3095
            2   C8y C    33.7528  -20.0494
            3   C1y C    31.3996  -19.7290
            4   C8x C    33.1647  -17.9116
            5   C8y C    34.9878  -19.1406
            6   N5x N    33.8867  -21.4765
            7   O2x O    30.2580  -18.8786
            8   C1y C    30.9627  -20.9871
            9   N5x N    34.6150  -17.9175
            10  C8y C    36.2459  -19.6999
            11  C8x C    35.2148  -22.0648
            12  C1y C    29.1512  -19.6707
            13  C1y C    29.5823  -20.9871
            14  O1a O    31.7724  -22.1231
            15  N5x N    36.4031  -21.1853
            16  N1a N    37.3526  -18.8727
            17  C1b C    27.8289  -19.2398
            18  O1a O    29.1337  -22.3036
            19  O2b O    26.7921  -20.1717
            20  P1b P    25.3943  -20.1717
            21  O2c O    24.0020  -20.1717
            22  O1c O    25.3884  -21.5637
            23  O1c O    25.3884  -18.7795
            24  P1b P    22.6100  -20.1658
            25  O1c O    22.6041  -21.5580
            26  O2b O    21.2177  -20.1658
            27  O1c O    22.6041  -18.7678
            28  C1y C    17.6496  -21.0095
            29  O2x O    18.8677  -20.3274
            30  C1y C    17.6274  -22.4027
            31  C1c C    16.4486  -20.2866
            32  C1y C    20.0748  -21.0448
            33  C1y C    18.8167  -23.1249
            34  O1a O    16.4038  -23.0788
            35  O1a O    15.2306  -20.9688
            36  C1y C    20.1106  -22.4431
            37  O1a O    18.8645  -24.5182
            38  O1a O    21.3169  -22.9675
            39  C1b C    16.4486  -18.8871
            40  O1a O    15.2374  -18.1878
BOND        43
            1     8  14 1 #Down
            2    10  15 2
            3    10  16 1
            4    12  17 1 #Up
            5    13  18 1 #Down
            6    17  19 1
            7    19  20 1
            8    20  21 1
            9    20  22 1
            10   20  23 2
            11   21  24 1
            12   24  25 1
            13   24  26 1
            14   24  27 2
            15    5   9 1
            16   11  15 1
            17   12  13 1
            18    1   2 1
            19    3   1 1 #Up
            20    1   4 1
            21    2   5 2
            22    2   6 1
            23    3   7 1
            24    3   8 1
            25    4   9 2
            26    5  10 1
            27    6  11 2
            28    7  12 1
            29    8  13 1
            30   28  29 1
            31   28  30 1
            32   28  31 1 #Up
            33   29  32 1
            34   30  33 1
            35   30  34 1 #Down
            36   31  35 1 #Down
            37   32  36 1
            38   32  26 1 #Up
            39   33  37 1 #Up
            40   36  38 1 #Up
            41   33  36 1
            42   31  39 1
            43   39  40 1

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