KEGG   DRUG: Pentalamide
Entry
D08332                      Drug                                   
Name
Pentalamide (INN);
Hestar (TN)
Formula
C12H17NO2
Exact mass
207.1259
Mol weight
207.27
Structure
Simcomp
Efficacy
Antifungal (local)
Comment
Dermatological, local fungicide
Other DBs
CAS: 5579-06-6
PubChem: 96025019
LigandBox: D08332
NIKKAJI: J149.173C
LinkDB
KCF data

ATOM        15
            1   C8x C    12.6000  -22.1900
            2   C8x C    12.6000  -23.5900
            3   C8x C    13.8124  -24.2900
            4   C8x C    15.0249  -23.5900
            5   C8y C    15.0249  -22.1900
            6   C8y C    13.8124  -21.4900
            7   C5a C    13.8124  -20.0902
            8   O5a O    12.5832  -19.3803
            9   N1a N    15.0080  -19.3998
            10  O2a O    16.2560  -21.4790
            11  C1b C    17.4612  -22.1747
            12  C1b C    18.6435  -21.4919
            13  C1b C    19.8375  -22.1812
            14  C1b C    21.0254  -21.4952
            15  C1a C    22.2165  -22.1829
BOND        15
            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     6   7 1
            8     7   8 2
            9     7   9 1
            10    5  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 1

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