Entry |
|
Name |
beta-Thujaplicin;
Hinokitiol;
4-Isopropyltropolone
|
Formula |
C10H12O2
|
Exact mass |
164.0837
|
Mol weight |
164.20
|
Structure |

|
Remark |
|
Brite |
Phytochemical compounds [BR:br08003]
Terpenoids
Monoterpenoids (C10)
Cyclic monoterpenes
C09904 beta-Thujaplicin
Classification of Japanese OTC drugs [BR:br08313]
Agents for integumentary system
58 Ringworm drugs
D04876 Hinokitiol
60 Hair remedies (incl. hair growth, hair tonic, anti-dandruff, and antipruritic)
D04876 Hinokitiol
Agents for dental and stomatological use
75 Toothache and pyorrhea remedies
D04876 Hinokitiol
Risk category of Japanese OTC drugs [BR:br08312]
Third-class OTC drugs
Inorganic and organic chemicals
Hinokitiol
D04876 Hinokitiol
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 12
1 C2y C 31.2170 -16.6548
2 C2x C 30.3754 -15.5458
3 C2y C 30.7104 -14.1898
4 C5x C 31.9707 -13.6120
5 C2x C 32.6220 -16.6800
6 C2x C 33.2236 -14.2339
7 C2x C 33.5099 -15.6019
8 O5x O 31.9923 -12.2379
9 C1c C 30.4979 -17.8501
10 C1a C 31.1737 -19.0705
11 C1a C 29.0744 -17.8244
12 O1a O 29.6025 -13.2725
BOND 12
1 3 4 1
2 1 5 2
3 4 6 1
4 2 3 2
5 5 7 1
6 1 2 1
7 6 7 2
8 4 8 2
9 1 9 1
10 9 10 1
11 9 11 1
12 3 12 1
|