KEGG   COMPOUND: C08296
Entry
C08296                      Compound                               
Name
Quisqualic acid
Formula
C5H7N3O5
Exact mass
189.0386
Mol weight
189.1262
Structure
Other DBs
CAS: 52809-07-1
PubChem: 10494
ChEBI: 8734
KNApSAcK: C00001391
PDB-CCD: QUS[PDBj]
NIKKAJI: J9.726H
KCF data

ATOM        13
            1   N4y N    34.0900  -28.8400
            2   C8y C    32.9000  -28.0000
            3   O7x O    33.6000  -30.1700
            4   C1b C    35.2800  -28.1400
            5   N4x N    31.7800  -28.8400
            6   O5x O    32.9000  -26.6000
            7   C8y C    32.2000  -30.1700
            8   C1c C    36.4700  -28.8400
            9   O6a O    31.2200  -31.1500
            10  C6a C    37.7300  -28.1400
            11  N1a N    36.4700  -30.2400
            12  O6a O    38.9200  -28.8400
            13  O6a O    37.7300  -26.7400
BOND        13
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     4   8 1
            8     7   9 2
            9     8  10 1
            10    8  11 1 #Up
            11   10  12 1
            12   10  13 2
            13    5   7 1

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Chemical substance (18)   
   PubChem (1)   
   ChEBI (1)   
   KNApSAcK (1)   
   MASSBANK (13)   
   NIKKAJI (1)   
   PDB-CCD (1)   
All databases (18)   

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