Entry |
|
Name |
Panthenol (USP/INN); DL-Panthenol |
Formula |
C9H19NO4
|
Exact mass |
205.1314
|
Mol weight |
205.2515
|
Structure |
|
Simcomp |
|
Efficacy |
Supplement (vitamin B5) |
Comment |
Pantothenic acid derivative, Provitamin
Component of Zentinic (TN)
|
Brite |
Risk category of Japanese OTC drugs [BR:br08312]
Third-class OTC drugs
Inorganic and organic chemicals
Panthenol
D03726 Panthenol (USP/INN)
|
Other DBs |
|
KCF data |
ATOM 14
1 C1c C 23.2400 -19.8100
2 C5a C 24.4300 -20.5100
3 C1d C 22.0500 -20.4400
4 N1b N 25.6900 -19.8100
5 O5a O 24.4300 -21.9100
6 C1b C 20.8600 -19.7400
7 C1b C 26.8800 -20.5100
8 C1b C 28.0700 -19.8100
9 C1b C 29.3300 -20.5100
10 O1a O 23.2400 -18.4100
11 O1a O 19.6447 -20.4351
12 O1a O 30.5366 -19.8000
13 C1a C 21.0601 -21.4299
14 C1a C 23.0399 -21.4299
BOND 13
1 1 2 1
2 1 3 1
3 2 4 1
4 2 5 2
5 3 6 1
6 4 7 1
7 7 8 1
8 8 9 1
9 1 10 1
10 6 11 1
11 9 12 1
12 3 13 1
13 3 14 1
|