6-Thio-5′-xanthylic acid

CAS Registry Number®

3237-49-8

CAS Name

6-Thio-5′-xanthylic acid

Molecular Formula

C10H13N4O8PS

Molecular Mass

380.27

Cite this Page

6-Thio-5′-xanthylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3237-49-8 (retrieved 2024-11-13) (CAS RN: 3237-49-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H13N4O8PS/c15-5-3(1-21-23(18,19)20)22-9(6(5)16)14-2-11-4-7(14)12-10(17)13-8(4)24/h2-3,5-6,9,15-16H,1H2,(H2,18,19,20)(H2,12,13,17,24)/t3-,5-,6-,9-/m1/s1

InChIKey

InChIKey=WMRIOGFRJLQENF-UUOKFMHZSA-N

SMILES

S=C1C2=C(N(C=N2)[C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)NC(=O)N1

Canonical SMILES

O=C1NC(=S)C=2N=CN(C2N1)C3OC(COP(=O)(O)O)C(O)C3O

Other Names for this Substance

  • 5′-Xanthylic acid, 6-thio-
  • Xanthosine, 6-thio-, 5′-(dihydrogen phosphate)
  • Xanthosine, 6-thio-, 5′-phosphate
  • 6-Thio-5′-xanthylic acid
  • 6-Thio-XMP

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CAS INSIGHTSTM
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