| | DRUG: Isopropyl palmitate | |
Entry |
|
Name |
Isopropyl palmitate (NF) |
Formula |
C19H38O2
|
Exact mass |
298.2872
|
Mol weight |
298.5038
|
Structure |
|
Simcomp |
|
Efficacy |
Pharmaceutic aid (vehicle, oleaginous) |
Other DBs |
|
KCF data |
ATOM 21
1 O6a O 17.0560 -15.6790
2 C7a C 17.0560 -17.0789
3 O7a O 15.8436 -17.7789
4 C1c C 14.6306 -17.0785
5 C1a C 13.4174 -17.7791
6 C1a C 14.6306 -15.6790
7 C1b C 18.2684 -17.7789
8 C1b C 19.4807 -17.0789
9 C1b C 20.6931 -17.7789
10 C1b C 21.9054 -17.0789
11 C1b C 23.1177 -17.7789
12 C1b C 24.3301 -17.0789
13 C1b C 25.5424 -17.7789
14 C1b C 26.7549 -17.0789
15 C1b C 27.9672 -17.7789
16 C1b C 29.1795 -17.0789
17 C1b C 30.3919 -17.7789
18 C1b C 31.6043 -17.0789
19 C1b C 32.8165 -17.7789
20 C1b C 34.0386 -17.0734
21 C1a C 35.2398 -17.7671
BOND 20
1 1 2 2
2 2 3 1
3 3 4 1
4 4 5 1
5 4 6 1
6 2 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 13 14 1
14 14 15 1
15 15 16 1
16 16 17 1
17 17 18 1
18 18 19 1
19 19 20 1
20 20 21 1
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