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

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H20ClN2O9P
Molecular Weight 426.743
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (Ethoxycarbonyl)phosphonic acid 1-(5-(2-chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-2-deoxy-?-D-erythro-pentofuranos-3-yl ester

SMILES

CCOC(=O)P(O)(=O)O[C@H]1C[C@@H](O[C@@H]1CO)N2C=C(CCCl)C(=O)NC2=O

InChI

InChIKey=HKFATXMBDOKNHI-HBNTYKKESA-N
InChI=1S/C14H20ClN2O9P/c1-2-24-14(21)27(22,23)26-9-5-11(25-10(9)7-18)17-6-8(3-4-15)12(19)16-13(17)20/h6,9-11,18H,2-5,7H2,1H3,(H,22,23)(H,16,19,20)/t9-,10+,11+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
(Ethoxycarbonyl)phosphonic acid 1-(5-(2-chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-2-deoxy-?-D-erythro-pentofuranos-3-yl ester
Systematic Name English
Uridine, 5-(2-chloroethyl)-2?-deoxy-, 3?-[hydrogen (ethoxycarbonyl)phosphonate]
Preferred Name English
Code System Code Type Description
CAS
115365-37-2
Created by admin on Wed Apr 02 20:50:27 GMT 2025 , Edited by admin on Wed Apr 02 20:50:27 GMT 2025
PRIMARY
FDA UNII
5YY8VX4SQN
Created by admin on Wed Apr 02 20:50:27 GMT 2025 , Edited by admin on Wed Apr 02 20:50:27 GMT 2025
PRIMARY
PUBCHEM
5272138
Created by admin on Wed Apr 02 20:50:27 GMT 2025 , Edited by admin on Wed Apr 02 20:50:27 GMT 2025
PRIMARY
EPA CompTox
DTXSID30921698
Created by admin on Wed Apr 02 20:50:27 GMT 2025 , Edited by admin on Wed Apr 02 20:50:27 GMT 2025
PRIMARY