| Entry |
|
|---|
| Name |
Croconazole (INN) |
|---|
| Formula |
C18H15ClN2O
|
|---|
| Exact mass |
310.0873
|
|---|
| Mol weight |
310.7775
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Antifungal
DG01883 Imidazole antifungal
|
|---|
| Remark |
|
|---|
| Efficacy |
Antifungal, Ergosterol biosynthesis inhibitor |
|---|
| Comment |
Imidazole derivative
|
|---|
| Target |
sterol 14alpha-demethylase [KO: K05917] |
|---|
| Pathway |
|
|---|
| Interaction |
|
|---|
| Structure map |
|
|---|
| Brite |
Drug groups [BR:br08330]
Antifungal
DG01883 Imidazole antifungal
DG01297 Croconazole
D07752 Croconazole
Antimicrobials [BR:br08307]
Antifungals
Ergosterol biosynthesis inhibitor
Imidazole
D07752 Croconazole (INN)
Drug groups [BR:br08330]
Antifungal
DG01883 Imidazole antifungal
DG01297 Croconazole
Antimicrobials abbreviations [BR:br08327]
Antifungals
Ergosterol biosynthesis inhibitor
Imidazole
DG01297 Croconazole
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 22
1 C8x C 25.5500 -22.8200
2 C8x C 25.9700 -21.4900
3 N4y N 24.7800 -20.6500
4 C8x C 23.6600 -21.4900
5 N5x N 24.1500 -22.8200
6 C8y C 25.9700 -17.2200
7 C8y C 25.9700 -18.6200
8 C8x C 27.1600 -19.3200
9 C8x C 28.4200 -18.6200
10 C8x C 28.4200 -17.2200
11 C8x C 27.1600 -16.5200
12 C8x C 19.9500 -15.1200
13 C8x C 19.9500 -16.5200
14 C8x C 21.1400 -17.2200
15 C8y C 22.3300 -16.5200
16 C8x C 22.3300 -15.1200
17 C8y C 21.1400 -14.4200
18 C1b C 23.5200 -17.2200
19 O2a O 24.7800 -16.5200
20 C2c C 24.7800 -19.2500
21 C2a C 23.5200 -18.6200
22 X Cl 21.1400 -13.0200
BOND 24
1 11 6 1
2 1 2 2
3 2 3 1
4 3 4 1
5 4 5 2
6 5 1 1
7 12 13 2
8 13 14 1
9 14 15 2
10 15 16 1
11 16 17 2
12 17 12 1
13 6 7 2
14 15 18 1
15 7 8 1
16 18 19 1
17 19 6 1
18 8 9 2
19 7 20 1
20 20 3 1
21 9 10 1
22 20 21 2
23 10 11 2
24 17 22 1
|
|---|
