KEGG   COMPOUND: C05994
Entry
C05994                      Compound                               
Name
2-Propylmalate;
2-Propylmalic acid;
Malic acid, 2-propyl-
Formula
C7H12O5
Exact mass
176.0685
Mol weight
176.1672
Structure
Reaction
R05063
Pathway
map00620  Pyruvate metabolism
Enzyme
4.1.3.-
Other DBs
PubChem: 8268
ChEBI: 28652
3DMET: B00886
NIKKAJI: J2.369.079I
LinkDB
KCF data

ATOM        12
            1   C1d C    25.8404  -21.3494
            2   C1b C    27.0572  -22.0446
            3   C1b C    25.1322  -20.1389
            4   C6a C    24.6365  -22.0510
            5   O1a O    26.5357  -20.1389
            6   C6a C    28.2612  -21.3428
            7   C1b C    25.1257  -18.7355
            8   O6a O    23.4198  -21.3494
            9   O6a O    24.6300  -23.4481
            10  O6a O    29.4651  -22.0446
            11  O6a O    28.2547  -19.9394
            12  C1a C    23.9238  -18.0493
BOND        11
            1     1   2 1
            2     1   3 1 #Down
            3     1   4 1
            4     1   5 1 #Up
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     4   9 2
            9     6  10 1
            10    6  11 2
            11    7  12 1

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