Cladribine

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Systematic / IUPAC Name: (2R,3S,5R)-5-(6-Amino-2-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol

ID: Reference2802

Other Names: 2-CdA ;
2-Chlorodeoxyadenosine;
Chlorodeoxyadenosine;
Cladaribine;
Cldado ; more

Formula: C10H12ClN5O3

Class: Therapeutics/Prescription Drugs

Spectral Data

Cladribine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 236
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 6/15/2015 12:13:29 PM
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Identificators

InChI InChI=1S/C10H12ClN5O3/c11-10-14-8(12)7-9(15-10)16(3-13-7)6-1-4(18)5(2-17)19-6/h3-6,17-18H,1-2H2,(H2,12,14,15)/t4-,5+,6+/m0/s1
InChI Key PTOAARAWEBMLNO-KVQBGUIXSA-N
Canonical SMILES C1C(C(OC1N2C=NC3=C2N=C(N=C3N)Cl)CO)O
CAS 4291638
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Other Names 2-CdA ;
2-Chlorodeoxyadenosine;
Chlorodeoxyadenosine;
Cladaribine;
Cldado;
Leustatin;
Litak;
Movectro;
Mylinax;
(2R,3S,5R)-5-(6-Amino-2-chloro-9H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol;
2-Chloro-6-amino-9-(2-deoxy-β-D-erythropentofuranosyl)purine

In Other Databases

PubChem 20279
DrugBank DB00242
ChEBI CHEBI:567361
ChemIDPlus 004291638
ChemSpider 19105; 1491
HMDb HMDB14387
KEGG D01370
Wikipedia Cladribine