KEGG   COMPOUND: C22080
Entry
C22080                      Compound                               
Name
(7R)-7-Hydroxyluteothin
Formula
C22H25NO6
Exact mass
399.1682
Mol weight
399.44
Structure
Reaction
Enzyme
Other DBs
PubChem: 384585139
LinkDB
KCF data

ATOM        29
            1   C8x C    11.9647  -16.5126
            2   C8y C    11.9647  -17.9120
            3   C8x C    13.1542  -18.6117
            4   C8x C    14.4136  -17.9120
            5   C8y C    14.4136  -16.5126
            6   C8x C    13.1542  -15.8130
            7   C1a C    16.7925  -17.9120
            8   C2c C    16.7925  -16.5126
            9   C2b C    15.6031  -15.8130
            10  C1a C    19.2414  -17.9120
            11  C2c C    19.2414  -16.5126
            12  C2b C    18.0519  -15.8130
            13  C1c C    21.6903  -16.5126
            14  C1b C    20.4309  -15.8130
            15  C8y C    22.8798  -15.8130
            16  C8y C    22.8798  -14.4136
            17  C1a C    21.6903  -13.7139
            18  O2x O    24.0692  -16.5126
            19  C8y C    25.3287  -15.8130
            20  C8y C    25.3287  -14.4136
            21  C8y C    24.0692  -13.7139
            22  O2a O    26.5181  -16.5126
            23  C1a C    26.5181  -13.7139
            24  O5x O    24.0692  -12.3145
            25  N2b N    10.7752  -18.6117 #+
            26  C1a C    27.7076  -15.8130
            27  O1a O    21.6903  -17.9126
            28  O3a O     9.5627  -17.9117 #-
            29  O3a O    10.7752  -20.0117
BOND        30
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     7   8 1
            8     8   9 2
            9     5   9 1
            10   10  11 1
            11   11  12 2
            12    8  12 1
            13   13  14 1
            14   11  14 1
            15   13  15 1
            16   15  16 2
            17   16  17 1
            18   15  18 1
            19   18  19 1
            20   19  20 2
            21   20  21 1
            22   16  21 1
            23   19  22 1
            24   20  23 1
            25   24  21 2
            26    2  25 1
            27   22  26 1
            28   13  27 1 #Down
            29   25  28 1
            30   25  29 2

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