U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C5H7N2O7P2.3Na
Molecular Weight 338.0351
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ZOLEDRONATE TRISODIUM ANHYDROUS

SMILES

[Na+].[Na+].[Na+].OC(CN1C=CN=C1)(P(O)([O-])=O)P([O-])([O-])=O

InChI

InChIKey=XNDMSJKSPQQLPT-UHFFFAOYSA-K
InChI=1S/C5H10N2O7P2.3Na/c8-5(15(9,10)11,16(12,13)14)3-7-2-1-6-4-7;;;/h1-2,4,8H,3H2,(H2,9,10,11)(H2,12,13,14);;;/q;3*+1/p-3

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C5H7N2O7P2
Molecular Weight 269.0658
Charge -3
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:40:35 UTC 2023
Edited
by admin
on Sat Dec 16 05:40:35 UTC 2023
Record UNII
7U1LPD9FR4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ZOLEDRONATE TRISODIUM ANHYDROUS
Common Name English
PHOSPHONIC ACID, (1-HYDROXY-2-(1H-IMIDAZOL-1-YL)ETHYLIDENE)BIS-, TRISODIUM SALT
Common Name English
Code System Code Type Description
CAS
827573-11-5
Created by admin on Sat Dec 16 05:40:36 UTC 2023 , Edited by admin on Sat Dec 16 05:40:36 UTC 2023
PRIMARY
FDA UNII
7U1LPD9FR4
Created by admin on Sat Dec 16 05:40:36 UTC 2023 , Edited by admin on Sat Dec 16 05:40:36 UTC 2023
PRIMARY
PUBCHEM
70695671
Created by admin on Sat Dec 16 05:40:36 UTC 2023 , Edited by admin on Sat Dec 16 05:40:36 UTC 2023
PRIMARY
Related Record Type Details
SOLVATE->ANHYDROUS
Related Record Type Details
ACTIVE MOIETY