Tetraacetylarabinosylcytosine structure

Tetraacetylarabinosylcytosine

[(2R,3R,4S,5R)-5-(4-acetamido-2-oxopyrimidin-1-yl)-3,4-diacetyloxyoxolan-2-yl]methyl acetate

Also Known As: Tetraacetylarabinosylcytosine, BRN 0771368, N-Acetyl-1-beta-D-arabinofuranosylcytosine 2',3',5'-triacetate, Cytosine, N-acetyl-1-beta-D-arabinofuransyl-, 2',3',5'-triacetate, CYTOSINE, N-ACETYL-1-beta-D-ARABINOFURANOSYL-, 2',3',5'-TRIACETATE, Acetamide, N-(1,2-dihydro-2-oxo-1-(2,3,5-tri-O-acetylbeta-D-arabinofuranosyl)-4-pyrimidinyl)-, [(2R,3R,4S,5R)-5-(4-acetamido-2-oxopyrimidin-1-yl)-3,4-diacetyloxyoxolan-2-yl]methyl acetate, [(2R,3R,4S,5R)-5-(4-acetamido-2-oxopyrimidin-1-yl)-4-acetyloxy-2-(acetyloxymethyl)oxolan-3-yl] acetate

CAS: 6742-08-1
Molecular Formula C17H21N3O9
Molecular Weight 411.12778 g/mol
LogP -0.47
Topological Polar Surface Area 152.12 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 11
Rotatable Bonds 6
Exact Mass 411.12778
Heavy Atoms 29
Complexity 865

Chemical Identifiers

CAS Number 6742-08-1
SMILES CC(=O)NC1=NC(=O)N(C=C1)[C@H]2[C@H]([C@@H]([C@H](O2)COC(=O)C)OC(=O)C)OC(=O)C

Product Overview

Tetraacetylarabinosylcytosine (CAS 6742-08-1), with molecular formula C17H21N3O9 and molecular weight 411.12778 g/mol. IUPAC: [(2R,3R,4S,5R)-5-(4-acetamido-2-oxopyrimidin-1-yl)-3,4-diacetyloxyoxolan-2-yl]methyl acetate.

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