Entry |
|
Name |
Sodium lauryl sulfate (JP18/NF) |
Formula |
C12H25O4S. Na
|
Exact mass |
288.1371
|
Mol weight |
288.38
|
Structure |

|
Simcomp |
|
Remark |
|
Efficacy |
Pharmaceutic aid (surfactant) |
Brite |
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
Chemicals
D01045 Sodium lauryl sulfate
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 18
1 C1a C 34.9879 -15.4237
2 C1b C 33.7961 -14.7227
3 C1b C 32.6042 -15.4237
4 C1b C 31.3424 -14.7227
5 O2a O 30.1506 -15.4237
6 S4a S 28.7486 -15.4237
7 O1d O 28.7486 -16.8257
8 O1d O 27.3464 -15.4237 #-
9 O1d O 28.7486 -14.0216
10 Z Na 25.2328 -15.3469 #+
11 C1b C 32.6042 -15.4237
12 C1b C 31.3424 -14.7227
13 C1b C 32.6042 -15.4237
14 C1b C 31.3424 -14.7227
15 C1b C 32.6042 -15.4237
16 C1b C 31.3424 -14.7227
17 C1b C 32.6042 -15.4237
18 C1b C 31.3424 -14.7227
BOND 16
1 1 2 1
2 5 6 1
3 6 7 2
4 6 8 1
5 6 9 2
6 4 5 1
7 3 4 1
8 3 12 1
9 11 12 1
10 11 14 1
11 13 14 1
12 13 16 1
13 15 16 1
14 15 18 1
15 17 18 1
16 17 2 1
BRACKET 1 31.2200 -16.0300 31.2200 -14.3500
1 32.8300 -14.3500 32.8300 -16.0300
1 5
ORIGINAL 1 3 4
REPEAT 1 11 12 13 14 15 16 17 18
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