KEGG   COMPOUND: C00327
Entry
C00327                      Compound                               

Name
L-Citrulline;
2-Amino-5-ureidovaleric acid;
Citrulline
Formula
C6H13N3O3
Exact mass
175.0957
Mol weight
175.1857
Structure
Remark
Same as: D07706
Reaction
Pathway
map00220  Arginine biosynthesis
map00997  Biosynthesis of various secondary metabolites - part 3
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01230  Biosynthesis of amino acids
Module
M00029  Urea cycle
M00844  Arginine biosynthesis, ornithine => arginine
M00845  Arginine biosynthesis, glutamate => acetylcitrulline => arginine
Enzyme
1.14.13.39      1.14.14.47      2.1.3.3         3.5.1.16        
3.5.1.20        3.5.3.6         3.5.3.18        6.3.4.5
Brite
Compounds with biological roles [BR:br08001]
 Peptides
  Amino acids
   Other amino acids
    C00327  L-Citrulline
Other DBs
CAS: 372-75-8
PubChem: 3621
ChEBI: 16349
ChEMBL: CHEMBL444814
KNApSAcK: C00001348
PDB-CCD: CIR[PDBj]
3DMET: B01217
NIKKAJI: J5.711H
KCF data

ATOM        12
            1   C1b C    24.4033  -15.4998
            2   C1b C    25.6020  -16.2213
            3   C1c C    23.1757  -16.1747
            4   C1b C    26.8298  -15.5463
            5   C6a C    21.9829  -15.4532
            6   N1a N    23.1525  -17.5712
            7   N1b N    28.0283  -16.2679
            8   O6a O    20.7552  -16.1398
            9   O6a O    22.0062  -14.0510
            10  C5a C    29.2503  -15.5870
            11  N1a N    30.4488  -16.3085
            12  O5a O    29.2736  -14.1848
BOND        11
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     3   6 1 #Down
            6     4   7 1
            7     5   8 1
            8     5   9 2
            9     7  10 1
            10   10  11 1
            11   10  12 2

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