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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H20N6O3
Molecular Weight 344.3684
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ABACAVIR HYDROXYACETATE

SMILES

NC1=NC2=C(N=CN2[C@@H]3C[C@H](COC(=O)CO)C=C3)C(NC4CC4)=N1

InChI

InChIKey=ZBBZROWQLKCFQK-KOLCDFICSA-N
InChI=1S/C16H20N6O3/c17-16-20-14(19-10-2-3-10)13-15(21-16)22(8-18-13)11-4-1-9(5-11)7-25-12(24)6-23/h1,4,8-11,23H,2-3,5-7H2,(H3,17,19,20,21)/t9-,11+/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H20N6O3
Molecular Weight 344.3684
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 05:18:26 UTC 2023
Edited
by admin
on Sat Dec 16 05:18:26 UTC 2023
Record UNII
B3C7MG354B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ABACAVIR HYDROXYACETATE
Common Name English
ACETIC ACID, 2-HYDROXY-, ((1S,4R)-4-(2-AMINO-6-(CYCLOPROPYLAMINO)-9H-PURIN-9-YL)-2-CYCLOPENTEN-1-YL)METHYL ESTER
Systematic Name English
PRURISOL
Common Name English
Code System Code Type Description
CAS
1446418-48-9
Created by admin on Sat Dec 16 05:18:27 UTC 2023 , Edited by admin on Sat Dec 16 05:18:27 UTC 2023
PRIMARY
DRUG BANK
DB12187
Created by admin on Sat Dec 16 05:18:27 UTC 2023 , Edited by admin on Sat Dec 16 05:18:27 UTC 2023
PRIMARY
FDA UNII
B3C7MG354B
Created by admin on Sat Dec 16 05:18:27 UTC 2023 , Edited by admin on Sat Dec 16 05:18:27 UTC 2023
PRIMARY
PUBCHEM
71605071
Created by admin on Sat Dec 16 05:18:27 UTC 2023 , Edited by admin on Sat Dec 16 05:18:27 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY