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

Details

Stereochemistry ABSOLUTE
Molecular Formula C10H12N4O6.2H2O
Molecular Weight 320.256
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of XANTHOSINE DIHYDRATE

SMILES

O.O.OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C=NC3=C2NC(=O)NC3=O

InChI

InChIKey=ZCCPXSQIUORWCO-LGVAUZIVSA-N
InChI=1S/C10H12N4O6.2H2O/c15-1-3-5(16)6(17)9(20-3)14-2-11-4-7(14)12-10(19)13-8(4)18;;/h2-3,5-6,9,15-17H,1H2,(H2,12,13,18,19);2*1H2/t3-,5-,6-,9-;;/m1../s1

HIDE SMILES / InChI

Approval Year

Name Type Language
XANTHOSINE DIHYDRATE
MI  
Systematic Name English
XANTHOSINE DIHYDRATE [MI]
Common Name English
9-.BETA.-D-RIBOFURANOSYL XANTHINE DIHYDRATE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID40975081
Created by admin on Sat Dec 16 01:36:52 UTC 2023 , Edited by admin on Sat Dec 16 01:36:52 UTC 2023
PRIMARY
CAS
5968-90-1
Created by admin on Sat Dec 16 01:36:52 UTC 2023 , Edited by admin on Sat Dec 16 01:36:52 UTC 2023
PRIMARY
PUBCHEM
18530347
Created by admin on Sat Dec 16 01:36:52 UTC 2023 , Edited by admin on Sat Dec 16 01:36:52 UTC 2023
PRIMARY
MERCK INDEX
m11533
Created by admin on Sat Dec 16 01:36:52 UTC 2023 , Edited by admin on Sat Dec 16 01:36:52 UTC 2023
PRIMARY Merck Index
FDA UNII
1U62I480SP
Created by admin on Sat Dec 16 01:36:52 UTC 2023 , Edited by admin on Sat Dec 16 01:36:52 UTC 2023
PRIMARY