KEGG   COMPOUND: C06662Help
Entry
C06662                      Compound                               

Name
Clavulanic acid;
Clavulanate
Formula
C8H9NO5
Exact mass
199.0481
Mol weight
199.1608
Structure
Mol fileKCF fileDB search
Remark
Same as: D07711
Reaction
Pathway
map00331  Clavulanic acid biosynthesis
map01130  Biosynthesis of antibiotics
map07011  Penicillins
Brite
Compounds with biological roles [BR:br08001]
 Antibiotics
  beta-Lactams
   Clavams
    C06662  Clavulanic acid
BRITE hierarchy
Other DBs
CAS: 58001-44-8
PubChem: 8887
ChEBI: 48947
ChEMBL: CHEMBL777
KNApSAcK: C00018091
PDB-CCD: J01[PDBj]
3DMET: B02085
NIKKAJI: J14.640D
KCF data Show

ATOM        14
            1   C1x C    21.9830  -17.4916
            2   C5x C    21.9830  -18.8914
            3   N1y N    23.3828  -18.8914
            4   C1y C    23.3828  -17.4916
            5   C1y C    24.7125  -19.3113
            6   C2y C    25.5523  -18.1914
            7   O2x O    24.7125  -17.0716
            8   C6a C    25.2024  -20.6410
            9   O6a O    26.6021  -20.6410
            10  O6a O    24.3625  -21.7607
            11  O5x O    20.7932  -19.5912
            12  C2b C    26.9477  -18.1914
            13  C1b C    27.6609  -16.9559
            14  O1a O    29.0547  -16.9558
BOND        15
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     1   4 1
            5     3   5 1
            6     5   6 1
            7     6   7 1
            8     4   7 1
            9     5   8 1 #Down
            10    8   9 1
            11    8  10 2
            12    2  11 2
            13    6  12 2
            14   12  13 1
            15   13  14 1

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