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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H14N2O6
Molecular Weight 294.2601
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (4R,12aS)-3,4,6,8,12,12a-Hexahydro-7-hydroxy-4-methyl-6,8-dioxo-2H-pyrido[1?,2?:4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylic acid

SMILES

C[C@@H]1CCO[C@H]2CN3C=C(C(O)=O)C(=O)C(O)=C3C(=O)N12

InChI

InChIKey=KVXRWTBFPVMIGC-SVRRBLITSA-N
InChI=1S/C13H14N2O6/c1-6-2-3-21-8-5-14-4-7(13(19)20)10(16)11(17)9(14)12(18)15(6)8/h4,6,8,17H,2-3,5H2,1H3,(H,19,20)/t6-,8+/m1/s1

HIDE SMILES / InChI

Molecular Formula C13H14N2O6
Molecular Weight 294.2601
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 10:53:27 GMT 2025
Edited
by admin
on Wed Apr 02 10:53:27 GMT 2025
Record UNII
DS7HC3Z5YA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Dolutegravir impurity F
Preferred Name English
(4R,12aS)-3,4,6,8,12,12a-Hexahydro-7-hydroxy-4-methyl-6,8-dioxo-2H-pyrido[1?,2?:4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylic acid
Systematic Name English
2H-Pyrido[1?,2?:4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylic acid, 3,4,6,8,12,12a-hexahydro-7-hydroxy-4-methyl-6,8-dioxo-, (4R,12aS)-
Systematic Name English
Code System Code Type Description
PUBCHEM
66594300
Created by admin on Wed Apr 02 10:53:27 GMT 2025 , Edited by admin on Wed Apr 02 10:53:27 GMT 2025
PRIMARY
CAS
1246616-73-8
Created by admin on Wed Apr 02 10:53:27 GMT 2025 , Edited by admin on Wed Apr 02 10:53:27 GMT 2025
PRIMARY
FDA UNII
DS7HC3Z5YA
Created by admin on Wed Apr 02 10:53:27 GMT 2025 , Edited by admin on Wed Apr 02 10:53:27 GMT 2025
PRIMARY
Related Record Type Details
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