Entry |
|
Name |
Malate;
Malic acid;
2-Hydroxybutanedioic acid
|
Formula |
C4H6O5
|
Exact mass |
134.0215
|
Mol weight |
134.09
|
Structure |

|
Remark |
|
Comment |
The name "malate" usually means (S)-Malate [CPD: C00149].
|
Brite |
Risk category of Japanese OTC drugs [BR:br08312]
Third-class OTC drugs
Inorganic and organic chemicals
Malic acid
D04843 Malic acid (NF)
|
Other DBs |
|
KCF data |
ATOM 9
1 O6a O 22.6562 -18.7094
2 C6a C 23.8686 -19.4095
3 C1c C 25.0812 -18.7094
4 C1b C 26.2936 -19.4095
5 C6a C 27.5061 -18.7094
6 O6a O 28.7187 -19.4095
7 O6a O 23.8686 -20.8095
8 O6a O 27.5061 -17.3096
9 O1a O 25.0812 -17.3097
BOND 8
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 2 7 2
7 5 8 2
8 3 9 1
|