KEGG   COMPOUND: C01591
Entry
C01591                      Compound                               

Name
Leupeptin
Formula
C20H38N6O4
Exact mass
426.2955
Mol weight
426.5535
Structure
Other DBs
CAS: 24365-47-7
PubChem: 4746
ChEBI: 6426
ChEMBL: CHEMBL191881
NIKKAJI: J93.946C
KCF data

ATOM        30
            1   C1b C    17.1500  -23.1000
            2   C1c C    18.3624  -22.4000
            3   C5a C    19.5749  -23.1000
            4   N1b N    20.7873  -22.4000
            5   C1c C    21.9997  -23.1000
            6   C1b C    23.2122  -22.4000
            7   C1b C    24.4246  -23.1000
            8   C1b C    25.6370  -22.4000
            9   N1b N    26.8495  -23.1000
            10  C2c C    28.0619  -22.4000
            11  N1a N    29.2744  -23.1000
            12  N2a N    28.0619  -21.0000
            13  C4a C    21.9997  -24.4999
            14  O4a O    20.7725  -25.2085
            15  O5a O    19.5749  -24.4998
            16  N1b N    18.3624  -20.0902
            17  C5a C    17.1276  -19.3900
            18  C1c C    15.9151  -20.0900
            19  C1b C    14.7027  -19.3900
            20  C1c C    13.4903  -20.0900
            21  O5a O    17.1221  -17.9903
            22  N1b N    15.9151  -22.3998
            23  C5a C    14.7027  -23.0998
            24  C1a C    13.4883  -22.3987
            25  O5a O    14.7027  -24.2200
            26  C1a C    12.2927  -19.3985
            27  C1a C    13.4902  -21.2799
            28  C1c C    17.1500  -24.5000
            29  C1a C    15.9376  -25.2000
            30  C1a C    18.3624  -25.2000
BOND        29
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   10  12 2
            12    5  13 1
            13   13  14 2
            14    3  15 2
            15    2  16 1 #Down
            16   16  17 1
            17   17  18 1
            18   18  19 1
            19   19  20 1
            20   17  21 2
            21   18  22 1 #Up
            22   22  23 1
            23   23  24 1
            24   23  25 2
            25   20  26 1
            26   20  27 1
            27    1  28 1
            28   28  29 1
            29   28  30 1

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