Entry |
|
Name |
1-Naphthylacetic acid (JAN); alpha-Naphthylacetic acid |
Formula |
C12H10O2
|
Exact mass |
186.0681
|
Mol weight |
186.21
|
Structure |

|
Simcomp |
|
Remark |
|
Efficacy |
Choleretic, Diagnostic aid (gallbladder-biliary tract imaging) |
Structure map |
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 14
1 C8x C 32.3088 -20.5589
2 C8x C 33.5185 -19.8581
3 C8y C 32.3053 -17.7616
4 C8x C 33.5154 -18.4616
5 O6a O 34.7279 -16.3657
6 C6a C 33.5178 -15.6657
7 C1b C 32.3065 -16.3636
8 C8y C 31.0921 -19.8581
9 C8y C 31.0921 -18.4565
10 C8x C 29.8782 -17.7557
11 C8x C 28.6643 -18.4565
12 C8x C 28.6643 -19.8581
13 C8x C 29.8782 -20.5589
14 O6a O 33.5190 -14.2641
BOND 15
1 8 1 1
2 1 2 2
3 2 4 1
4 3 9 1
5 3 4 2
6 8 9 2
7 9 10 1
8 10 11 2
9 11 12 1
10 12 13 2
11 13 8 1
12 5 6 1
13 6 7 1
14 7 3 1
15 6 14 2
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