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Details

Stereochemistry ACHIRAL
Molecular Formula C22H27FN6O6
Molecular Weight 490.4848
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of RALTEGRAVIR-1-ETHOXYACETHYDRAZONE, (E)-

SMILES

CCO\C(C)=N\NC(=O)C(=O)NC(C)(C)C1=NC(C(=O)NCC2=CC=C(F)C=C2)=C(O)C(=O)N1C

InChI

InChIKey=AVFOYNPBSATWBZ-KKMKTNMSSA-N
InChI=1S/C22H27FN6O6/c1-6-35-12(2)27-28-19(33)18(32)26-22(3,4)21-25-15(16(30)20(34)29(21)5)17(31)24-11-13-7-9-14(23)10-8-13/h7-10,30H,6,11H2,1-5H3,(H,24,31)(H,26,32)(H,28,33)/b27-12+

HIDE SMILES / InChI

Molecular Formula C22H27FN6O6
Molecular Weight 490.4848
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:24:10 UTC 2023
Edited
by admin
on Sat Dec 16 11:24:10 UTC 2023
Record UNII
9EJ47VP5SY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RALTEGRAVIR-1-ETHOXYACETHYDRAZONE, (E)-
Common Name English
ETHYL (1E)-N-((2-(4-(((4-FLUOROPHENYL)METHYL)CARBAMOYL)-5-HYDROXY-1-METHYL-6-OXO-1,6-DIHYDROPYRIMIDIN-2-YL)PROPAN-2-YL)OXAMOYL)ETHANEHYDRAZONATE
Systematic Name English
RALTEGRAVIR POTASSIUM IMPURITY F [EP IMPURITY]
Common Name English
RALTEGRAVIR E-ETHOXYACETHYDRAZONE ANALOG [USP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
59382802
Created by admin on Sat Dec 16 11:24:10 UTC 2023 , Edited by admin on Sat Dec 16 11:24:10 UTC 2023
PRIMARY
FDA UNII
9EJ47VP5SY
Created by admin on Sat Dec 16 11:24:10 UTC 2023 , Edited by admin on Sat Dec 16 11:24:10 UTC 2023
PRIMARY
CAS
2138805-56-6
Created by admin on Sat Dec 16 11:24:10 UTC 2023 , Edited by admin on Sat Dec 16 11:24:10 UTC 2023
NON-SPECIFIC STEREOCHEMISTRY
Related Record Type Details
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CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP