KEGG   DRUG: Ornithine aspartate
Entry
D08303            Mixture   Drug                                   
Name
Ornithine aspartate;
Hepa-Merz (TN)
Formula
C4H7NO4. C5H12N2O2
Exact mass
265.1274
Mol weight
265.2637
Structure
Simcomp
Component
Ornithine [DR:D08302], L-Aspartic acid [DR:D00013]
Efficacy
Hepatoprotectant
Other DBs
CAS: 3230-94-2
PubChem: 96024990
LigandBox: D08303
KCF data

ATOM        18
            1   C1c C    16.8856  -23.1123
            2   C6a C    15.6948  -22.4819
            3   C1b C    18.1465  -22.4819
            4   N1a N    16.8856  -24.7234
            5   O6a O    14.5040  -23.1824
            6   O6a O    15.6948  -21.0810
            7   C1b C    19.3373  -23.1123
            8   C1b C    20.5281  -22.4819
            9   N1a N    21.7189  -23.1123
            10  O6a O    26.6222  -23.0423
            11  C6a C    27.8355  -22.3418
            12  C1c C    29.0488  -23.0423
            13  C1b C    30.2620  -22.3418
            14  C6a C    31.4752  -23.0423
            15  O6a O    32.6886  -22.3418
            16  O6a O    27.8355  -20.9411
            17  O6a O    31.4752  -24.4431
            18  N1a N    29.0488  -24.4430
BOND        16
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     7   8 1
            8     8   9 1
            9    10  11 1
            10   11  12 1
            11   12  13 1
            12   13  14 1
            13   14  15 1
            14   11  16 2
            15   14  17 2
            16   12  18 1 #Down

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Drug (1)   
   LigandBox (1)   
Chemical substance (1)   
   PubChem (1)   
All databases (2)   

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