KEGG   DRUG: Icomucret
Entry
D08931                      Drug                                   
Name
Icomucret (USAN)
Formula
C20H32O3
Exact mass
320.2351
Mol weight
320.4663
Structure
Simcomp
Remark
Same as: C04742
Efficacy
Glycoprotein secretion stimulant
Comment
Treatment of dry eye
Other DBs
CAS: 54845-95-3
PubChem: 96025614
ChEBI: 15558
LigandBox: D08931
NIKKAJI: J303.917J
KCF data

ATOM        23
            1   C2b C    26.8800  -13.7200
            2   C2b C    25.5500  -13.7200
            3   C1b C    27.9300  -14.3500
            4   C1b C    24.5000  -14.3500
            5   C1b C    29.0500  -13.7200
            6   C2b C    23.3800  -13.7200
            7   C1b C    30.1700  -14.3500
            8   C2b C    22.0500  -13.7200
            9   C6a C    31.2900  -13.7200
            10  C1b C    21.0000  -15.8900
            11  O6a O    32.4100  -14.3500
            12  O6a O    31.2900  -12.4600
            13  C2b C    21.9800  -18.0600
            14  C2b C    23.3100  -18.0600
            15  C2b C    24.3600  -17.4300
            16  C2b C    25.4800  -18.0600
            17  C1c C    26.7400  -18.0600
            18  C1b C    27.8600  -17.4300
            19  C1b C    28.9100  -18.0600
            20  C1b C    30.0300  -17.4300
            21  C1b C    31.1500  -18.0600
            22  C1a C    32.2000  -17.3600
            23  O1a O    27.3700  -19.6700
BOND        22
            1     1   2 2
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     4   6 1
            6     5   7 1
            7     6   8 2
            8     7   9 1
            9     8  10 1
            10    9  11 1
            11    9  12 2
            12   10  13 1
            13   13  14 2
            14   14  15 1
            15   15  16 2
            16   16  17 1
            17   17  18 1
            18   18  19 1
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22   17  23 1 #Down

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