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Details

Stereochemistry EPIMERIC
Molecular Formula C16H24N6O6.ClH
Molecular Weight 432.859
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of [3-Acetyloxy-2-[(2-amino-6-oxo-1H-purin-9-yl)methoxy]propyl] (2S)-2-amino-3-methylbutanoate hydrochloride

SMILES

Cl.CC(C)[C@H](N)C(=O)OCC(COC(C)=O)OCN1C=NC2=C1NC(N)=NC2=O

InChI

InChIKey=UUCQCTDPDBFLFF-GQNCZFCYSA-N
InChI=1S/C16H24N6O6.ClH/c1-8(2)11(17)15(25)27-5-10(4-26-9(3)23)28-7-22-6-19-12-13(22)20-16(18)21-14(12)24;/h6,8,10-11H,4-5,7,17H2,1-3H3,(H3,18,20,21,24);1H/t10?,11-;/m0./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
[3-Acetyloxy-2-[(2-amino-6-oxo-1H-purin-9-yl)methoxy]propyl] (2S)-2-amino-3-methylbutanoate hydrochloride
Systematic Name English
L-Valine, 3-(acetyloxy)-2-[(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]propyl ester, hydrochloride (1:1)
Preferred Name English
Code System Code Type Description
CAS
960495-42-5
Created by admin on Wed Apr 02 18:46:10 GMT 2025 , Edited by admin on Wed Apr 02 18:46:10 GMT 2025
PRIMARY
PUBCHEM
171390123
Created by admin on Wed Apr 02 18:46:10 GMT 2025 , Edited by admin on Wed Apr 02 18:46:10 GMT 2025
PRIMARY
FDA UNII
6Q4LKJ8W6Y
Created by admin on Wed Apr 02 18:46:10 GMT 2025 , Edited by admin on Wed Apr 02 18:46:10 GMT 2025
PRIMARY