Systematic / IUPAC Name: 4-Amino-1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
ID: Reference3171
Other Names:
β-Ara C;
β-Arabinosylcytosine;
β-Cytosine arabinoside;
β-D-Arabinosylcytosine;
(β-D-Arabinofuranosyl)cytosine
; more
Formula: C9H13N3O5
Class: Therapeutics/Prescription Drugs Endogenous Metabolites
Cytarabine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Q Exactive Orbitrap |
No. of Spectral Trees | 2 |
No. of Spectra | 234 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | ESI |
Analyzers | FT |
Last Modification | 10/23/2015 8:45:50 AM |
InChI | InChI=1S/C9H13N3O5/c10-5-1-2-12(9(16)11-5)8-7(15)6(14)4(3-13)17-8/h1-2,4,6-8,13-15H,3H2,(H2,10,11,16)/t4-,6-,7+,8-/m1/s1 |
InChI Key | UHDGCWIWMRVCDJ-CCXZUQQUSA-N |
Canonical SMILES | C1=CN(C(=O)N=C1N)C2C(C(C(O2)CO)O)O |
CAS | 147944 |
Splash | |
Other Names |
β-Ara C; β-Arabinosylcytosine; β-Cytosine arabinoside; β-D-Arabinosylcytosine; (β-D-Arabinofuranosyl)cytosine; 1β-Arabinofuranasylcytosine; 1-β-D-Arabinofaranosylcytosine; 1β-D-Arabinofuranosylcytosine; 1β-D-Arabinosylcytosine; 1-Arabinofuranosylcytosine; Alexan; Arabinocytidine; Arabinofuranosyl cytidine; Arabinofuranosylcytosine; Arabitin; Aracytidine; Aracytin; Aracytine; Arafcyt; Citarabina; Cytarabin; Cytarabinoside; Cytarabinum; Cytarbel; Cytartbine; Cytonal; Cytosar; Cytosar-U; Cytosine β-D-arabinofuranoside; Cytosine β-D-arabinoside; Cytosine 1-β-D-arabinofuranoside; Cytosine arabinofuranoside; Cytosine arabinose; Cytosine, β-D-arabinoside; Cytosine, 1-β-D-arabinofuranosyl-; Cytosine, 1-β-D-arabinosyl-; Depocyte; Erpalfa; Iretin; Spongocytidine; Tarabine; Udicil; 1-β-D-Arabinofuranosyl-4-amino-2(1H)pyrimidinone; 2(1H)-Pyrimidinone, 4-amino-1-β-D-arabinofuranosyl-; 4-Amino-1-β-D-arabinofuranosyl-2(1H)-pyrimidinone; 4-Amino-1-β-D-arabinofuranosylpyrimidin-2(1H)-one; 4-Amino-1-((2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one; 4-Amino-1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2-dihydropyrimidin-2-one; 4-Amino-1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2-one; 4-Amino-1-arabinofuranosyl-2-oxo-1,2-dihydropyrimidin; 4-Amino-1-arabinofuranosyl-2-oxo-1,2-dihydropyrimidine; 4-Amino-1-b-D-arabinofuranosyl-2-(1H)-pyrimidinone |
Wikipedia | Cytarabine |
PubChem | 6253 |
ChEBI | CHEBI:28680 |
ChemIDPlus | 000147944 |
HMDb | HMDB15122 |
DrugBank | DB00987 |
KEGG | C02961; D00168 |
ChemSpider | 6017 |