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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H20N6O2
Molecular Weight 304.3476
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-HYDROXYABACAVIR

SMILES

NC1=NC(NC2CC2)=C3N=CN([C@@H]4C[C@H](CO)C[C@H]4O)C3=N1

InChI

InChIKey=WROLYMYANKQWEI-FXBDTBDDSA-N
InChI=1S/C14H20N6O2/c15-14-18-12(17-8-1-2-8)11-13(19-14)20(6-16-11)9-3-7(5-21)4-10(9)22/h6-10,21-22H,1-5H2,(H3,15,17,18,19)/t7-,9+,10+/m0/s1

HIDE SMILES / InChI

Molecular Formula C14H20N6O2
Molecular Weight 304.3476
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:33:21 GMT 2023
Edited
by admin
on Sat Dec 16 18:33:21 GMT 2023
Record UNII
7XAP7Q177F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-HYDROXYABACAVIR
Common Name English
(1R,2R,4S)-2-(2-AMINO-6-(CYCLOPROPYLAMINO)-9H-PURIN-9-YL)-4-(HYDROXYMETHYL)CYCLOPENTAN-1-OL
Systematic Name English
Code System Code Type Description
PUBCHEM
119026160
Created by admin on Sat Dec 16 18:33:21 GMT 2023 , Edited by admin on Sat Dec 16 18:33:21 GMT 2023
PRIMARY
FDA UNII
7XAP7Q177F
Created by admin on Sat Dec 16 18:33:21 GMT 2023 , Edited by admin on Sat Dec 16 18:33:21 GMT 2023
PRIMARY
Related Record Type Details
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