Basic information
- CAS
6829-31-8- Standard SMILES
Cc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)nc1N- InChIKey
ZAYHVCMSTBRABG-JAGXHNFQSA-N- Molecular formula
- C10H15N3O5
- Average molar mass
- 257.24 g/mol
- Monoisotopic mass
- 257.10117059
Overview
structure
Names & identifiers
- Preferred name
- 5-methyl ara-C
- IUPAC
- 4-amino-1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-2-one
- English name
- 5-Methylarabinosylcytosine
- Molecular formula
- C10H15N3O5
- Molecular weight
- 257.24
Names & synonyms
6829-31-85-Methylarabinosylcytosine5-Methyl ara-C1 beta-D-arabinofuranosyl-5-methylcytosineRefChem:1030821beta-D-Arabinofuranosyl-5-methylcytosine4-amino-1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-2-one4-Amino-1-((2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-5-methylpyrimidin-2(1H)-one4-Amino-1-beta-D-arabinofuranosyl-5-methyl-2(1H)-pyrimidinoneCytarabine EP Impurity I1-?-D-Arabinofuranosyl-5-methylcytosineNSC 96372
Show more names
Cytarabine Impurity 11arabino-5-methylcytidine1-β-D-Arabinofuranosyl-5-methylcytosine1-β-D-Arabinofuranosyl-5-methylcytosine1-beta-arabinofuranosyl-5-methyl?cytosine1-(β-D-Arabinofuranosyl)-5-methyl-cytosinCytarabine Impurity 11(Cytarabine EP Impurity I)
NSC 529544SCHEMBL5953706DTXSID1010169781-beta-D-Arabinofuranosyl-5-methylcytosine4-Amino-1-|A-D-arabinofuranosyl-5-methyl-2(1H)-pyrimidinone4-Amino-1-beta-D-arabinofuranosyl-5-methylpyrimidin-2(1H)-one2(1H)-Pyrimidinone, 4-amino-1-beta-D-arabinofuranosyl-5-methyl-4-amino-1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidin-2-one
Properties
Computed structural properties
- XLogP
- -2
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 422
Physicochemical properties
- Melting point
- 229 °C · >229°C (dec.)
- Boiling point
- 537.5 · 537.5±60.0 °C(Predicted)
- Density
- 1.79 · 1.79±0.1 g/cm3(Predicted)
- storage temp.
- -20 °C · Hygroscopic, -20°C Freezer, Under inert atmosphere
- solubility
- DMSO (Slightly), Methanol (Slightly), Water (Slightly, Heated, Sonicated)
- form
- Solid
- pka
- 13.48 · 13.48±0.70(Predicted)
- color
- White to Off-White
Chemistry & industry
Applications
Uses1-β-D-Arabinofuranosyl-5-methylcytosine is a potential antiviral nucleoside.
Suppliers30 total
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
攀纳燊（河南）医药科学技术有限公司0371-65325800 13700860222 · [email protected]
孟成科技（上海）有限公司400-820-6829 · [email protected]
希瓦生物科技（广州）有限公司13268215580 · [email protected]
上海梅凯科技有限公司021-68689288 15300790979 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]
郑州安步防护用具有限公司+86-0371-88006763; +86-15988602810 · [email protected]
深圳摩科生化科技有限公司18627923403 · [email protected]
TLC梯尔希（南京）药物研发有限公司18012923235 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
坛墨质检科技股份有限公司19850211281 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…