| Entry |
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| Name |
Benzyl nicotinate;
Nicotinic acid benzyl ester
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| Formula |
C13H11NO2
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| Exact mass |
213.079
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| Mol weight |
213.2319
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| Structure |
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| Remark |
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
C CARDIOVASCULAR SYSTEM
C04 PERIPHERAL VASODILATORS
C04A PERIPHERAL VASODILATORS
C04AC Nicotinic acid and derivatives
C04AC01 Nicotinic acid
D01419 Benzyl nicotinate (JAN)
C10 LIPID MODIFYING AGENTS
C10A LIPID MODIFYING AGENTS, PLAIN
C10AD Nicotinic acid and derivatives
C10AD02 Nicotinic acid
D01419 Benzyl nicotinate (JAN)
Classification of Japanese OTC drugs [BR:br08313]
Agents for integumentary system
57 Analgesic, antipruritic, astringent, and anti-inflammatory remedies (incl. gel patches)
D01419 Benzyl nicotinate (JAN)
Risk category of Japanese OTC drugs [BR:br08312]
Third-class OTC drugs
Inorganic and organic chemicals
Benzyl nicotinate
D01419 Benzyl nicotinate (JAN)
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 16
1 N5x N 22.5154 -18.2391
2 C8x C 22.5154 -19.6429
3 C8x C 23.7340 -20.3448
4 C8x C 24.9455 -19.6429
5 C8y C 24.9455 -18.2391
6 C8x C 23.7340 -17.5372
7 C7a C 26.1524 -17.5372
8 O7a O 27.3648 -18.2321
9 C1b C 28.5772 -17.5302
10 C8y C 29.7895 -18.2250
11 C8x C 29.7939 -19.6223
12 C8x C 31.0063 -20.3170
13 C8x C 32.2142 -19.6146
14 C8x C 32.2096 -18.2173
15 C8x C 30.9973 -17.5224
16 O6a O 26.1478 -16.1334
BOND 17
1 7 8 1
2 2 3 1
3 8 9 1
4 3 4 2
5 9 10 1
6 4 5 1
7 5 6 2
8 6 1 1
9 5 7 1
10 10 11 2
11 11 12 1
12 12 13 2
13 13 14 1
14 14 15 2
15 15 10 1
16 1 2 2
17 7 16 2
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