2,2'-Anhydro-1-(beta-Arabinofuranosyl)Orotic Acid
[CAS# 33886-20-3]

Identification

• Name: 2,2'-Anhydro-1-(beta-Arabinofuranosyl)Orotic Acid
• Synonyms: 6H-Furo(2',3'-4,5)Oxazolo(3,2-A)Pyrimidine-8-Carboxylic Acid, 2,3,3A,9A-Tetrahydro-3-Hydroxy-2-(Hydroxymethyl)-6-Oxo-, (2R-(2Alpha,3Beta,3Abeta,9Abeta))-; Ara-Orotic Acid
• Molecular Formula: C₁₀H₁₀N₂O₇
• Molecular Weight: 270.20
• CAS Registry Number: 33886-20-3
• SMILES: [C@@H]12O[C@@H]([C@@H](O)[C@@H]1OC3=NC(=O)C=C(N23)C(=O)O)CO
• InChI: 1S/C10H10N2O7/c13-2-4-6(15)7-8(18-4)12-3(9(16)17)1-5(14)11-10(12)19-7/h1,4,6-8,13,15H,2H2,(H,16,17)/t4-,6-,7+,8-/m1/s1
• InChIKey: DSHIOTZLUFLXCT-CCXZUQQUSA-N

Properties

• Density: 2.196g/cm³ (Cal.)
• Boiling point: 541.349°C at 760 mmHg (Cal.)
• Flash point: 281.198°C (Cal.)