Xanthosine, 2′,3′,5′-triacetate
CAS Registry Number®
61444-45-9
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CAS Name
Xanthosine, 2′,3′,5′-triacetateMolecular Formula
C16H18N4O9Molecular Mass
410.34Cite this Page
Xanthosine, 2′,3′,5′-triacetate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=61444-45-9 (retrieved ) (CAS RN: 61444-45-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
135-137 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C16H18N4O9/c1-6(21)26-4-9-11(27-7(2)22)12(28-8(3)23)15(29-9)20-5-17-10-13(20)18-16(25)19-14(10)24/h5,9,11-12,15H,4H2,1-3H3,(H2,18,19,24,25)/t9-,11-,12-,15-/m1/s1
InChIKey
InChIKey=PRDVADIVOOTBMC-SDBHATRESA-N
SMILES
O(C(C)=O)[C@H]1[C@@H](O[C@H](COC(C)=O)[C@H]1OC(C)=O)N2C3=C(N=C2)C(=O)NC(=O)N3
Canonical SMILES
O=C(OCC1OC(N2C=NC=3C(=O)NC(=O)NC32)C(OC(=O)C)C1OC(=O)C)C
Other Names for this Substance
- Xanthosine, 2′,3′,5′-triacetate
- Xanthosine triacetate
- NSC 70898