KEGG   DRUG: Calcium propionateHelp
Entry
D09875                      Drug                                   

Name
Calcium propionate (NF)
Formula
C6H10CaO4
Exact mass
186.0205
Mol weight
186.2192
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Remark
Same as: C18379
Efficacy
Pharmaceutic aid (preservative)
Other DBs
CAS: 4075-81-4
PubChem: 135626629
ChEMBL: CHEMBL3186661
LinkDB All DBs
KCF data Show

ATOM        11
            1   C7a C    30.2400  -29.3300
            2   C1b C    31.3600  -30.0300
            3   C1a C    32.4800  -29.3300
            4   O7a O    29.1200  -30.0300
            5   O6a O    30.2400  -28.0000
            6   Z   Ca   27.6500  -28.9100
            7   C7a C    25.2700  -28.4200
            8   C1b C    24.1500  -27.7900
            9   C1a C    23.0300  -28.4200
            10  O7a O    26.3900  -27.7900
            11  O6a O    25.2700  -29.7500
BOND        10
            1     1   2 1
            2     2   3 1
            3     1   4 1
            4     1   5 2
            5     4   6 1
            6     7   8 1
            7     8   9 1
            8     7  10 1
            9     7  11 2
            10    6  10 1

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