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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H26N6O
Molecular Weight 342.4386
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 9-((1R,4S)-4-(TERT-BUTOXYMETHYL)CYCLOPENT-2-ENYL)-N6-CYCLOPROPYL-9H-PURINE-2,6-DIAMINE

SMILES

CC(C)(C)OC[C@H]1C[C@H](C=C1)N2C=NC3=C2N=C(N)N=C3NC4CC4

InChI

InChIKey=GUTJAVLKEBLQJK-YPMHNXCESA-N
InChI=1S/C18H26N6O/c1-18(2,3)25-9-11-4-7-13(8-11)24-10-20-14-15(21-12-5-6-12)22-17(19)23-16(14)24/h4,7,10-13H,5-6,8-9H2,1-3H3,(H3,19,21,22,23)/t11-,13+/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H26N6O
Molecular Weight 342.4386
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 Sat Dec 16 06:36:00 GMT 2023
Edited
by admin
on Sat Dec 16 06:36:00 GMT 2023
Record UNII
T7I4I2O3WT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
9-((1R,4S)-4-(TERT-BUTOXYMETHYL)CYCLOPENT-2-ENYL)-N6-CYCLOPROPYL-9H-PURINE-2,6-DIAMINE
Systematic Name English
6-(CYCLOPROPYLAMINO)-9-((1R,4S)-4-(((1,1-DIMETHYLETHYL)OXY)METHYL)CYCLOPENT-2-ENYL)-9H-PURINE-2-AMINE
Systematic Name English
T-BUTYL DERIVATIVE ABACAVIR [USP IMPURITY]
Common Name English
N6-CYCLOPROPYL-9-((1R,4S)-4-((1,1-DIMETHYLETHOXY)METHYL)CYCLOPENT-2-EN-1-YL)-9H-PURINE-2,6-DIAMINE [WHO-IP]
Common Name English
9H-PURINE-2,6-DIAMINE, N6-CYCLOPROPYL-9-((1R,4S)-4-((1,1-DIMETHYLETHOXY)METHYL)-2-CYCLOPENTEN-1-YL)-
Systematic Name English
ABACAVIR SULFATE IMPURITY F [EP IMPURITY]
Common Name English
ABACAVIR SULFATE IMPURITY F [WHO-IP]
Common Name English
Code System Code Type Description
CAS
1443421-68-8
Created by admin on Sat Dec 16 06:36:00 GMT 2023 , Edited by admin on Sat Dec 16 06:36:00 GMT 2023
PRIMARY
PUBCHEM
73425537
Created by admin on Sat Dec 16 06:36:00 GMT 2023 , Edited by admin on Sat Dec 16 06:36:00 GMT 2023
PRIMARY
FDA UNII
T7I4I2O3WT
Created by admin on Sat Dec 16 06:36:00 GMT 2023 , Edited by admin on Sat Dec 16 06:36:00 GMT 2023
PRIMARY
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