KEGG   COMPOUND: C06371
Entry
C06371                      Compound                               
Name
Lacto-N-tetraose;
beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-D-Glc
Formula
C26H45NO21
Exact mass
707.2484
Mol weight
707.6296
Structure
Remark
Same as: G00395
Reaction
Enzyme
Brite
Compounds with biological roles [BR:br08001]
 Carbohydrates
  Oligosaccharides
   Tetrasaccharides
    C06371  Lacto-N-tetraose
Other DBs
PubChem: 8607
ChEBI: 30248
NIKKAJI: J510.843H
LinkDB
KCF data

ATOM        48
            1   C1y C    24.3980  -18.7718
            2   C1y C    24.4037  -20.1660
            3   O2a O    25.6056  -18.0717
            4   O2x O    23.1903  -18.0776
            5   C1y C    23.1961  -20.8604
            6   N1b N    25.6114  -20.8661
            7   C1y C    25.6056  -16.6774
            8   C1y C    21.9827  -18.7775
            9   O2a O    23.1961  -22.2605
            10  C1y C    21.9884  -20.1719
            11  C1y C    26.8133  -15.9831
            12  C1y C    24.3921  -15.9890
            13  C1b C    20.7750  -18.0834
            14  C1y C    21.9827  -22.9606
            15  O1a O    20.7808  -20.8778
            16  C1y C    26.8074  -14.5888
            17  O1a O    28.0209  -16.6774
            18  C1y C    24.3921  -14.5888
            19  O1a O    23.1903  -16.6891
            20  O1a O    19.5674  -18.7834
            21  O2x O    20.7634  -22.2605
            22  C1y C    21.9827  -24.3606
            23  O2a O    28.0150  -13.8828
            24  O2x O    25.5997  -13.8887
            25  C1b C    23.1787  -13.8945
            26  C1y C    19.5617  -22.9606
            27  C1y C    20.7634  -25.0666
            28  O1a O    23.1961  -25.0666
            29  C1y C    29.2169  -12.8560
            30  O1a O    21.9710  -14.5946
            31  C1y C    19.5617  -24.3606
            32  C1b C    18.3540  -22.2605
            33  O1a O    20.7750  -26.4668
            34  C1y C    30.4186  -13.5561
            35  C1y C    29.2169  -11.4755
            36  O1a O    18.3540  -25.0666
            37  O1a O    17.2805  -23.1706
            38  C1y C    31.6320  -12.8620
            39  O1a O    30.4127  -14.9563
            40  O2x O    30.4303  -10.7739
            41  C1y C    31.6379  -11.4696
            42  O1a O    32.8397  -13.5678
            43  O1a O    32.8456  -10.7822
            44  C1b C    28.0079  -10.7779
            45  O1a O    26.7906  -11.4685
            46  C5a C    26.8324  -20.1600
            47  C1a C    28.0449  -20.8600
            48  O5a O    26.8319  -18.7602
BOND        51
            1     1   3 1 #Up
            2     1   4 1
            3     2   5 1
            4     2   6 1 #Down
            5     7   3 1 #Up
            6     4   8 1
            7     5   9 1 #Up
            8     5  10 1
            9     7  11 1
            10    7  12 1
            11    8  13 1 #Up
            12   14   9 1 #Up
            13   10  15 1 #Down
            14   11  16 1
            15   11  17 1 #Down
            16   12  18 1
            17   12  19 1 #Up
            18   13  20 1
            19   14  21 1
            20   14  22 1
            21   16  23 1 #Up
            22   16  24 1
            23   18  25 1 #Up
            24   21  26 1
            25   22  27 1
            26   22  28 1 #Down
            27   29  23 1 #Down
            28   25  30 1
            29   26  31 1
            30   26  32 1 #Up
            31   27  33 1 #Up
            32   29  34 1
            33   29  35 1
            34   31  36 1 #Up
            35   32  37 1
            36   34  38 1
            37   34  39 1 #Up
            38   35  40 1
            39   38  41 1
            40   38  42 1 #Down
            41   41  43 1 #Either
            42    8  10 1
            43   18  24 1
            44   27  31 1
            45   40  41 1
            46   35  44 1 #Up
            47    1   2 1
            48   44  45 1
            49    6  46 1
            50   46  47 1
            51   46  48 2

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