U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H22N6O4.ClH
Molecular Weight 374.823
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-METHYL VALACYCLOVIR HYDROCHLORIDE

SMILES

Cl.CN[C@@H](C(C)C)C(=O)OCCOCN1C=NC2=C1N=C(N)NC2=O

InChI

InChIKey=RLJNMIUABOJDNS-FVGYRXGTSA-N
InChI=1S/C14H22N6O4.ClH/c1-8(2)9(16-3)13(22)24-5-4-23-7-20-6-17-10-11(20)18-14(15)19-12(10)21;/h6,8-9,16H,4-5,7H2,1-3H3,(H3,15,18,19,21);1H/t9-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C14H22N6O4
Molecular Weight 338.3623
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:05:49 GMT 2025
Edited
by admin
on Mon Mar 31 23:05:49 GMT 2025
Record UNII
11TUH2Q1IH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACYCLOVIR N-METHYL-L-VALINATE HYDROCHLORIDE
Preferred Name English
N-METHYL VALACYCLOVIR HYDROCHLORIDE
Common Name English
2-((2-AMINO-6-OXO-1,6-DIHYDRO-9H-PURIN-9-YL)METHOXY)ETHYL N-METHYL-L-VALINATE HYDROCHLORIDE
Systematic Name English
VALACYCLOVIR RELATED COMPOUND C HYDROCHLORIDE
Common Name English
L-VALINE, N-METHYL-, 2-((2-AMINO-1,6-DIHYDRO-6-OXO-9H-PURIN-9-YL)METHOXY)ETHYL ESTER, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
135564816
Created by admin on Mon Mar 31 23:05:49 GMT 2025 , Edited by admin on Mon Mar 31 23:05:49 GMT 2025
PRIMARY
EPA CompTox
DTXSID60158859
Created by admin on Mon Mar 31 23:05:49 GMT 2025 , Edited by admin on Mon Mar 31 23:05:49 GMT 2025
PRIMARY
FDA UNII
11TUH2Q1IH
Created by admin on Mon Mar 31 23:05:49 GMT 2025 , Edited by admin on Mon Mar 31 23:05:49 GMT 2025
PRIMARY
CAS
1346617-39-7
Created by admin on Mon Mar 31 23:05:49 GMT 2025 , Edited by admin on Mon Mar 31 23:05:49 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE