Xanthosine, 6-S-(4-methylphenyl)-6-thio-, 2′,3′,5′-triacetate

CAS Registry Number®

135041-24-6

CAS Name

Xanthosine, 6-S-(4-methylphenyl)-6-thio-, 2′,3′,5′-triacetate

Molecular Formula

C23H24N4O8S

Molecular Mass

516.52

Cite this Page

Xanthosine, 6-S-(4-methylphenyl)-6-thio-, 2′,3′,5′-triacetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=135041-24-6 (retrieved 2024-11-29) (CAS RN: 135041-24-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C23H24N4O8S/c1-11-5-7-15(8-6-11)36-21-17-20(25-23(31)26-21)27(10-24-17)22-19(34-14(4)30)18(33-13(3)29)16(35-22)9-32-12(2)28/h5-8,10,16,18-19,22H,9H2,1-4H3,(H,25,26,31)/t16-,18-,19-,22-/m1/s1

InChIKey

InChIKey=FGOSQAPWZULDRY-WGQQHEPDSA-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(SC4=CC=C(C)C=C4)=NC(=O)N3

Canonical SMILES

O=C1N=C(SC2=CC=C(C=C2)C)C=3N=CN(C3N1)C4OC(COC(=O)C)C(OC(=O)C)C4OC(=O)C

Other Names for this Substance

  • Xanthosine, 6-S-(4-methylphenyl)-6-thio-, 2′,3′,5′-triacetate

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