| Entry |
|
|---|
| Name |
Aceglatone (JAN/INN);
Glucaron (TN) |
|---|
| Formula |
C10H10O8
|
|---|
| Exact mass |
258.0376
|
|---|
| Mol weight |
258.1816
|
|---|
| Structure |
|
|---|
| Efficacy |
Antineoplastic |
|---|
| Target |
|
|---|
| Pathway |
| hsa00040 | Pentose and glucuronate interconversions |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
Enzymes
Hydrolases (EC3)
Glycosidases
GUSB
D01805 Aceglatone (JAN/INN)
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 18
1 C1y C 26.0400 -17.0800
2 C7x C 25.2700 -18.2000
3 O7x O 26.0400 -19.3200
4 C1y C 27.3700 -17.5000
5 C1y C 27.3700 -18.9000
6 C1y C 28.7000 -19.3200
7 C7x C 29.5400 -18.2700
8 O7x O 28.7000 -17.0800
9 O6a O 30.9400 -18.2700
10 O6a O 23.8700 -18.2000
11 O7a O 25.6200 -15.7500
12 O7a O 29.1200 -20.7200
13 C7a C 24.2200 -15.7500
14 C7a C 30.5200 -20.7200
15 C1a C 31.2200 -21.9324
16 O6a O 31.2200 -19.5076
17 C1a C 23.5200 -14.5376
18 O6a O 23.5200 -16.9624
BOND 19
1 4 1 1
2 1 2 1
3 7 9 2
4 2 3 1
5 2 10 2
6 3 5 1
7 1 11 1 #Down
8 4 5 1
9 6 12 1 #Up
10 5 6 1
11 6 7 1
12 7 8 1
13 8 4 1
14 11 13 1
15 12 14 1
16 14 15 1
17 14 16 2
18 13 17 1
19 13 18 2
|
|---|
