KEGG   DRUG: Potassium sorbate
Entry
D02411                      Drug                                   
Name
Potassium sorbate (NF)
Formula
C6H7O2. K
Exact mass
150.0083
Mol weight
150.2169
Structure
Simcomp
Efficacy
Pharmaceutic aid (antimicrobial preservative)
Other DBs
CAS: 24634-61-5
PubChem: 7849469
ChEBI: 77868
LigandBox: D02411
NIKKAJI: J1.006E
KCF data

ATOM        9
            1   O6a O    20.2999  -19.3433 #-
            2   C6a C    21.5123  -18.6433
            3   C2b C    22.7247  -19.3433
            4   C2b C    23.9373  -18.6433
            5   C2b C    25.1497  -19.3433
            6   C2b C    26.3621  -18.6433
            7   C1a C    27.5746  -19.3433
            8   O6a O    21.5123  -17.2433
            9   Z   K    18.4927  -19.3084 #+
BOND        7
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     6   7 1
            7     2   8 2

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