KEGG   DRUG: Sodium ethasulfate
Entry
D05858                      Drug                                   
Name
Sodium ethasulfate (USAN);
Sodium etasulfate (INN)
Formula
C8H17O4S. Na
Exact mass
232.0745
Mol weight
232.28
Structure
Efficacy
Detergent
Other DBs
CAS: 126-92-1
PubChem: 47207519
LigandBox: D05858
NIKKAJI: J57.770G
LinkDB
KCF data

ATOM        14
            1   Z   Na   31.2606  -18.0796 #+
            2   C1b C    31.7106  -19.1980
            3   C1c C    30.5159  -19.8888
            4   C1b C    29.3214  -19.1980
            5   C1b C    28.1198  -19.8888
            6   C1b C    26.9251  -19.1980
            7   C1a C    25.7306  -19.8888
            8   O2a O    33.1449  -19.9451
            9   S4a S    34.3597  -19.2782
            10  C1b C    30.5159  -21.2800
            11  C1a C    29.3065  -21.9782
            12  O1d O    35.5721  -18.5782
            13  O1d O    35.0372  -20.4808
            14  O1d O    33.6630  -18.0416 #-
BOND        12
            1     4   5 1
            2     2   3 1
            3     5   6 1
            4     6   7 1
            5     2   8 1
            6     3   4 1
            7     8   9 1
            8     3  10 1
            9    10  11 1
            10    9  12 2
            11    9  13 2
            12    9  14 1

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