U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C10H14N6O6
Molecular Weight 314.2548
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of XANTHOSINE, 2,6-DIOXIME

SMILES

OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C=NC3=C2NC(NC3=NO)=NO

InChI

InChIKey=SHMRWYRHOVJFOZ-UUOKFMHZSA-N
InChI=1S/C10H14N6O6/c17-1-3-5(18)6(19)9(22-3)16-2-11-4-7(14-20)12-10(15-21)13-8(4)16/h2-3,5-6,9,17-21H,1H2,(H2,12,13,14,15)/t3-,5-,6-,9-/m1/s1

HIDE SMILES / InChI

Molecular Formula C10H14N6O6
Molecular Weight 314.2548
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 20:12:32 GMT 2025
Edited
by admin
on Tue Apr 01 20:12:32 GMT 2025
Record UNII
E4Q5W92UYC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
XANTHOSINE, 2,6-DIOXIME
Systematic Name English
NSC-130263
Preferred Name English
9H-PURINE, 2,6-BIS(HYDROXYAMINO)-9-.BETA.-D-RIBOFURANOSYL-
Systematic Name English
XANTHOSINE, DIOXIME
Common Name English
Code System Code Type Description
FDA UNII
E4Q5W92UYC
Created by admin on Tue Apr 01 20:12:32 GMT 2025 , Edited by admin on Tue Apr 01 20:12:32 GMT 2025
PRIMARY
PUBCHEM
21140199
Created by admin on Tue Apr 01 20:12:32 GMT 2025 , Edited by admin on Tue Apr 01 20:12:32 GMT 2025
PRIMARY
EPA CompTox
DTXSID40936278
Created by admin on Tue Apr 01 20:12:32 GMT 2025 , Edited by admin on Tue Apr 01 20:12:32 GMT 2025
PRIMARY
NSC
130263
Created by admin on Tue Apr 01 20:12:32 GMT 2025 , Edited by admin on Tue Apr 01 20:12:32 GMT 2025
PRIMARY
CAS
16033-28-6
Created by admin on Tue Apr 01 20:12:32 GMT 2025 , Edited by admin on Tue Apr 01 20:12:32 GMT 2025
PRIMARY