KEGG   DRUG: Clodronate disodium
Entry
D03544                      Drug                                   
Name
Clodronate disodium (USAN);
Sodium clodronate hydrate (JAN);
Bonefos (TN)
Formula
CH2Cl2O6P2. 4H2O. 2Na
Exact mass
359.8922
Mol weight
360.9172
Structure
Simcomp
Class
Musculo-skeletal system agent
 DG03232  Osteoporosis agent
  DG01600  Bisphosphonate
Remark
ATC code: M05BA02
Chemical structure group: DG00781
Efficacy
Antiresorptive, Osteoporosis agent
Comment
Bisphosphonate
Interaction
Structure map
map07047  Osteoporosis drugs
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
     M05BA02 Clodronic acid
      D03544  Clodronate disodium (USAN)
Drug groups [BR:br08330]
 Musculo-skeletal system agent
  DG03232  Osteoporosis agent
   DG01600  Bisphosphonate
    DG00781  Clodronic acid
     D03544  Clodronate disodium
Drug groups [BR:br08330]
 Musculo-skeletal system agent
  DG03232  Osteoporosis agent
   DG01600  Bisphosphonate
    DG00781  Clodronic acid
Other DBs
CAS: 88416-50-6
PubChem: 47205853
LigandBox: D03544
LinkDB
KCF data

ATOM        17
            1   C1d C    16.6881  -12.1805
            2   P1b P    15.7024  -12.1751
            3   P1b P    17.6421  -12.1805
            4   O1c O    15.7024  -13.5267 #-
            5   O1c O    14.2568  -12.1280
            6   O1c O    15.7024  -10.8239
            7   O1c O    17.6315  -13.5267 #-
            8   O1c O    18.9245  -12.1492
            9   O1c O    17.6421  -10.8239
            10  X   Cl   16.6843  -14.3498
            11  X   Cl   16.6920  -10.0804
            12  Z   Na   13.7900  -14.4900 #+
            13  Z   Na   18.9700  -14.4900 #+
            14  O0  O    24.9900  -13.2300
            15  O0  O    24.9900  -13.2300
            16  O0  O    24.9900  -13.2300
            17  O0  O    24.9900  -13.2300
BOND        10
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     3   8 1
            8     3   9 2
            9     1  10 1
            10    1  11 1
BRACKET     1    22.7500  -14.2100   22.7500  -12.4600
            1    25.6900  -12.4600   25.6900  -14.2100
            1  4
 ORIGINAL  1   14
 REPEAT    1   15  16  17

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