| Entry |
|
|---|
| Name |
Zoledronate disodium (USAN);
Zoledronate disodium hydrate |
|---|
| Formula |
C5H8N2O7P2. 4H2O. 2Na
|
|---|
| Exact mass |
388.0025
|
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| Mol weight |
388.11
|
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| Structure |
|
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| Simcomp |
|
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| Class |
Musculo-skeletal system agent
DG03232 Osteoporosis agent
DG01600 Bisphosphonate
|
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| Remark |
| Product (DG00787): | D01968<JP/US> |
|
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| Efficacy |
Antiresorptive, Osteoporosis agent, Farnesylpyrophosphate synthetase inhibitor |
|---|
| Comment |
Bisphosphonate
|
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| Target |
|
|---|
| Pathway |
| hsa00900 | Terpenoid backbone biosynthesis |
|
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| Interaction |
|
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| Structure map |
|
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
M MUSCULO-SKELETAL SYSTEM
M05 DRUGS FOR TREATMENT OF BONE DISEASES
M05B DRUGS AFFECTING BONE STRUCTURE AND MINERALIZATION
M05BA Bisphosphonates
M05BA08 Zoledronic acid
D06378 Zoledronate disodium (USAN)
Drug groups [BR:br08330]
Musculo-skeletal system agent
DG03232 Osteoporosis agent
DG01600 Bisphosphonate
DG00787 Zoledronic acid
D06378 Zoledronate disodium
Target-based classification of drugs [BR:br08310]
Enzymes
Transferases (EC2)
Alkyl/Aryl transferases
FDPS
D06378 Zoledronate disodium (USAN)
Drug groups [BR:br08330]
Musculo-skeletal system agent
DG03232 Osteoporosis agent
DG01600 Bisphosphonate
DG00787 Zoledronic acid
|
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 22
1 O0 O 29.7532 -21.9474
2 Z Na 17.3489 -25.3385 #+
3 Z Na 25.9710 -25.1586 #+
4 C1d C 22.1900 -23.7300
5 P1b P 23.4500 -24.3600
6 P1b P 21.0700 -24.3600
7 C1b C 22.1900 -22.4000
8 O1c O 19.8800 -23.7300
9 O1c O 21.0700 -25.7600
10 O1c O 19.5300 -25.3400 #-
11 O1c O 24.5700 -23.7300
12 O1c O 23.4500 -25.7600
13 O1c O 24.7100 -25.1300 #-
14 O1a O 22.1900 -25.1300
15 N4y N 23.3800 -21.7000
16 C8x C 24.7100 -22.1200
17 N5x N 25.5500 -21.0000
18 C8x C 24.7100 -19.8800
19 C8x C 23.3800 -20.3000
20 O0 O 29.7532 -21.9474
21 O0 O 29.7532 -21.9474
22 O0 O 29.7532 -21.9474
BOND 16
1 4 5 1
2 4 6 1
3 4 7 1
4 6 8 2
5 6 9 1
6 6 10 1
7 5 11 2
8 5 12 1
9 5 13 1
10 4 14 1
11 7 15 1
12 15 16 1
13 16 17 2
14 17 18 1
15 18 19 2
16 15 19 1
BRACKET 1 27.3700 -23.0300 27.3700 -21.0000
1 30.5200 -21.0000 30.5200 -23.0300
1 4
ORIGINAL 1 1
REPEAT 1 20 21 22
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