KEGG   COMPOUND: C02614
Entry
C02614                      Compound                               
Name
(S)-2-Methylmalate;
(S)-2-Methylmalic acid;
(S)-Citramalate;
(S)-Citramalic acid;
(S)-alpha-Hydroxypyrotartaric acid;
L-Citramalate;
L-Citramalic acid;
L-alpha-Hydroxypyrotartaric acid;
(2S)-2-Hydroxy-2-methylbutanedioate;
(S)-2-Hydroxy-2-methylsuccinic acid
Formula
C5H8O5
Exact mass
148.0372
Mol weight
148.114
Structure
Reaction
Pathway
map00660  C5-Branched dibasic acid metabolism
map01100  Metabolic pathways
Enzyme
2.8.3.11        2.8.3.22        4.1.3.22        4.2.1.34
Other DBs
CAS: 6236-09-5
PubChem: 5599
ChEBI: 29003 30936
KNApSAcK: C00001181
3DMET: B00466
NIKKAJI: J73.969C
KCF data

ATOM        10
            1   O6a O    29.6101  -18.0600
            2   C6a C    30.8225  -18.7600
            3   C1b C    32.0350  -18.0600
            4   C1d C    33.2474  -18.7600
            5   C6a C    34.4598  -18.0600
            6   O6a O    35.6723  -18.7600
            7   O6a O    34.4598  -16.6600
            8   O6a O    30.8225  -20.1600
            9   C1a C    33.9474  -19.9724
            10  O1a O    32.5474  -19.9724
BOND        9
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     5   7 2
            7     2   8 2
            8     4   9 1 #Down
            9     4  10 1 #Up

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