cytarabine

Synonyms: "cytarabine", "Cytosine arabinoside", "Ara-C", "Arabinocytidine", "Cytosar", "Arabinosylcytosine", "Cytarabin", "Tarabine", "Udicil", "Alexan", "Cytosar-U", "1-beta-D-Arabinofuranosylcytosine", "Aracytin", "Arabitin", "Cytarabina", "Depocyt", "Erpalfa", "Arafcyt", "DepoCyte", "Arabinofuranosylcytosine", "Citarabina", "Cytarabinum", "Aracytine", "Aracytidine", "Cytosinearabinoside", "Cytosine-beta-D-arabinofuranoside", "Cytosine beta-D-arabinofuranoside", "Cytarabinoside", "Cytonal", "Cytosine arabinofuranoside", "beta-D-Arabinosylcytosine"

Source: Cytarabine is a chemotherapy drug.

Identifiers:

IUPAC Name: 4-amino-1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
CAS Number: 147-94-4
PubChem ID: 6253
InChiKey: UHDGCWIWMRVCDJ-CCXZUQQUSA-N
Canonical SMILES: C1=CN(C(=O)N=C1N)C2C(C(C(O2)CO)O)O

Structural Properties:

Molecular Formula: C₉H₁₃N₃O₅
Molecular Weight: 243.22

Pharmacophore Features:

Number of bond donors: 4
Number of bond acceptors: 5
Number of atoms different from hydrogen: 17

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Evidence Supporting This Chemical as an Emerging Contaminant

Ikehata, K., Gamal El-Din, M., & Snyder, S. A. (2008). Ozonation and advanced oxidation treatment of emerging organic pollutants in water and wastewater. Ozone: Science and Engineering, 30(1), 21-26.

External Links

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2D-structure

3D-structure