N6,3'-O-Dibenzoyl-2'-Deoxyadenosine
[CAS# 51549-54-3]

Identification

• Name: N6,3'-O-Dibenzoyl-2'-Deoxyadenosine
• Synonyms: [(2R,3S,5R)-5-[6-(Benzoylamino)Purin-9-Yl]-2-(Hydroxymethyl)Tetrahydrofuran-3-Yl] Benzoate; Benzoic Acid [(2R,3S,5R)-2-(Hydroxymethyl)-5-[6-[(Oxo-Phenylmethyl)Amino]-9-Purinyl]-3-Tetrahydrofuranyl] Ester; Benzoic Acid [(2R,3S,5R)-5-[6-(Benzoylamino)Purin-9-Yl]-2-Methylol-Tetrahydrofuran-3-Yl] Ester
• Molecular Formula: C₂₄H₂₁N₅O₅
• Molecular Weight: 459.46
• CAS Registry Number: 51549-54-3
• EINECS: 257-272-0
• SMILES: [C@H]1(O[C@@H]([C@H](C1)OC(=O)C2=CC=CC=C2)CO)[N]3C4=C(N=C3)C(=NC=N4)NC(=O)C5=CC=CC=C5
• InChI: 1S/C24H21N5O5/c30-12-18-17(34-24(32)16-9-5-2-6-10-16)11-19(33-18)29-14-27-20-21(25-13-26-22(20)29)28-23(31)15-7-3-1-4-8-15/h1-10,13-14,17-19,30H,11-12H2,(H,25,26,28,31)/t17-,18+,19+/m0/s1
• InChIKey: GRASBJRYLQJMMU-IPMKNSEASA-N

Properties

• Density: 1.48g/cm³ (Cal.)