Entry |
|
Name |
Clavulanic acid;
Clavulanate
|
Formula |
C8H9NO5
|
Exact mass |
199.0481
|
Mol weight |
199.16
|
Structure |

|
Remark |
|
Reaction |
|
Pathway |
map01110 | Biosynthesis of secondary metabolites |
|
Brite |
Compounds with biological roles [BR:br08001]
Antibiotics
beta-Lactams
Clavams
C06662 Clavulanic acid
Drug groups [BR:br08330]
Antibacterial
DG01710 beta-Lactam antibiotic
DG01713 Penicillin skeleton group
DG01487 Clavam
DG01261 Clavulanic acid
D07711 Clavulanic acid
DG01479 beta-Lactamase inhibitor
DG01261 Clavulanic acid
D07711 Clavulanic acid
Antimicrobials [BR:br08307]
Antibacterials
Cell wall biosynthesis inhibitor, beta-lactam
Beta-lactamase inhibitor
D07711 Clavulanic acid (INN)
|
Other DBs |
|
KCF data |
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
|