KEGG   DRUG: Ethyl nicotinate
Entry
D08274                      Drug                                   
Name
Ethyl nicotinate;
Nicotine acid ethyl ester;
Mucotherm (TN)
Formula
C8H9NO2
Exact mass
151.0633
Mol weight
151.16
Structure
Simcomp
Efficacy
Supplement (vitamin B)
Other DBs
CAS: 614-18-6
PubChem: 96024961
ChEBI: 192166
LigandBox: D08274
NIKKAJI: J27.971D
LinkDB
KCF data

ATOM        11
            1   C8y C    25.1300  -18.3400
            2   C8x C    25.1300  -19.7400
            3   N5x N    23.8700  -20.4400
            4   C8x C    22.6800  -19.7400
            5   C8x C    22.6800  -18.3400
            6   C8x C    23.8700  -17.6400
            7   C7a C    26.3200  -17.6400
            8   O7a O    27.5100  -18.3400
            9   O6a O    26.3200  -16.2400
            10  C1b C    28.7000  -17.6400
            11  C1a C    29.9600  -18.3400
BOND        11
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     1   7 1
            8     7   8 1
            9     7   9 2
            10    8  10 1
            11   10  11 1

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