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Zoledronic acid (monohydrate) (Standard)

CAT: 0804-HY-13777AR-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-13777AR-01Size:5 mg
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Description
Zoledronic acid (monohydrate) (Standard) is the analytical standard of Zoledronic acid (monohydrate) . This product is intended for research and analytical applications. Zoledronic acid monohydrate (Zoledronate monohydrate) is a third-generation bisphosphonate (BP), with potent anti-resorptive activity. Zoledronic acid monohydrate inhibits the differentiation and apoptosis of osteoclasts. Zoledronic acid monohydrate also has anti-cancer effects[1].
CAS Number
165800-06-6
Product Name Alternative
Zoledronate monohydrate (Standard) ; CGP 42446 monohydrate (Standard) ; CGP42446A monohydrate (Standard) ; ZOL 446 monohydrate (Standard)
UNSPSC
12352005
Target
Apoptosis; Autophagy; Bacterial; Reference Standards
Type
Reference Standards
Related Pathways
Anti-infection; Apoptosis; Autophagy; Others
Field of Research
Cancer; Metabolic Disease
Assay Protocol
https://www.medchemexpress.com/zoledronic-acid-monohydrate-standard.html
Smiles
OC(P(O)(O)=O)(P(O)(O)=O)CN1C=CN=C1.[H]O[H]
Molecular Formula
C5H12N2O8P2
Molecular Weight
290.10
References & Citations
[1]Lianwei Wang, et al. Various pathways of zoledronic acid against osteoclasts and bone cancer metastasis: a brief review. BMC Cancer. 2020; 20: 1059.|[2]Hyung Joon Kim, et al. Zoledronate Enhances Osteocyte-Mediated Osteoclast Differentiation by IL-6/RANKL Axis. Int J Mol Sci. 2019 Mar; 20 (6) : 1467.|[3]Xiao-Lin Huang, et al. Zoledronic acid inhibits osteoclast differentiation and function through the regulation of NF-κB and JNK signalling pathways. Int J Mol Med. 2019 Aug;44 (2) :582-592.|[4]XIN HUANG, et al. Dose-dependent inhibitory effects of zoledronic acid on osteoblast viability and function in vitro. Mol Med Rep. 2016 Jan; 13 (1) : 613-622.|[5]Samantha Pozzi, et al. High-dose zoledronic acid impacts bone remodeling with effects on osteoblastic lineage and bone mechanical properties. Clin Cancer Res. 2009 Sep 15;15 (18) :5829-39.|[6]Shea GKH, et al. Oral Zoledronic acid bisphosphonate for the treatment of chronic low back pain with associated Modic changes: A pilot randomized controlled trial. J Orthop Res. 2022 Feb 23.
Shipping Conditions
Room temperature
Scientific Category
Reference Standards

Chemical Information

Zoledronic acid monohydrate

See also: Zoledronic Acid (annotation moved to).

CAS Number165800-06-6
PubChem CID121586
IUPAC Name(1-hydroxy-2-imidazol-1-yl-1-phosphonoethyl)phosphonic acid;hydrate
Molecular FormulaC5H12N2O8P2
Molecular Weight290.11
Topological Polar Surface Area154
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count9
Rotatable Bond Count4
Heavy Atom Count17
Formal Charge0
Complexity327
SMILES
C1=CN(C=N1)CC(O)(P(=O)(O)O)P(=O)(O)O.O
InChI
InChI=1S/C5H10N2O7P2.H2O/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);1H2
InChIKey
FUXFIVRTGHOMSO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Zoledronic acid monohydrate
CAS: 165800-06-6
CID: 121586
Formula: C5H12N2O8P2
MW: 290.11
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight290.11
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count9
Rotatable Bond Count4
Exact Mass290.00688934
Monoisotopic Mass290.00688934
Topological Polar Surface Area154 Ų
Heavy Atom Count17
Formal Charge0
Complexity327
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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