KEGG   COMPOUND: C21186
Entry
C21186                      Compound                               
Name
6-Tuliposide B;
6-O-[(3S)-3,4-Dihydroxy-2-methylenebutanoyl]-D-glucose
Formula
C11H18O9
Exact mass
294.0951
Mol weight
294.2552
Structure
Reaction
Enzyme
Other DBs
PubChem: 315431309
KCF data

ATOM        20
            1   C1y C    23.4713  -15.4669
            2   O2x O    22.2579  -14.7725
            3   C1y C    23.4713  -16.8787
            4   O1a O    24.6789  -14.7725
            5   C1y C    21.0385  -15.4669
            6   C1y C    22.2579  -17.5729
            7   O1a O    24.6789  -17.6430
            8   C1y C    21.0385  -16.8787
            9   C1b C    19.8250  -14.7667
            10  O1a O    22.2636  -18.9789
            11  O1a O    19.8250  -17.5789
            12  O7a O    18.6113  -15.4669
            13  C7a C    17.4193  -14.7951
            14  C2c C    16.2104  -15.4930
            15  C1c C    15.0017  -14.7951
            16  C1b C    13.7930  -15.4930
            17  O1a O    12.5841  -14.7951
            18  O6a O    17.4119  -13.3997
            19  C2a C    16.2104  -16.8886
            20  O1a O    15.0021  -13.3702
BOND        20
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Either
            4     2   5 1
            5     3   6 1
            6     3   7 1 #Down
            7     5   8 1
            8     5   9 1 #Up
            9     6  10 1 #Up
            10    8  11 1 #Down
            11    9  12 1
            12    6   8 1
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   16  17 1
            18   13  18 2
            19   14  19 2
            20   15  20 1 #Up

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