KEGG   DRUG: Sodium butyrate
Entry
D08998                      Drug                                   
Name
Sodium butyrate (USP)
Formula
C4H7O2. Na
Exact mass
110.0344
Mol weight
110.09
Structure
Simcomp
Efficacy
Food additive (veterinary)
Other DBs
CAS: 156-54-7
PubChem: 96025681
ChEBI: 64103
LigandBox: D08998
NIKKAJI: J21.150H
LinkDB
KCF data

ATOM        7
            1   C1b C    27.3000  -17.0800
            2   C6a C    28.4900  -16.3800
            3   C1b C    26.1100  -16.3800
            4   O6a O    29.7500  -17.0800 #-
            5   O6a O    28.4900  -14.9800
            6   C1a C    24.8500  -17.0800
            7   Z   Na   32.6900  -17.0800 #+
BOND        5
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     2   5 2
            5     3   6 1

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