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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H14ClN5O
Molecular Weight 255.704
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (1S,4R)-4-(2-AMINO-6-(CYCLOPROPYLAMINO)-9H-PURIN-9-YL)-CYCLOPENT-1-METHANOL

SMILES

NC1=NC(N[C@@H]2C[C@H](CO)C=C2)=C(N)C(Cl)=N1

InChI

InChIKey=RNURTQFRFNOOPJ-RITPCOANSA-N
InChI=1S/C10H14ClN5O/c11-8-7(12)9(16-10(13)15-8)14-6-2-1-5(3-6)4-17/h1-2,5-6,17H,3-4,12H2,(H3,13,14,15,16)/t5-,6+/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
(1S,4R)-4-(2-AMINO-6-(CYCLOPROPYLAMINO)-9H-PURIN-9-YL)-CYCLOPENT-1-METHANOL
Systematic Name English
ABACAVIR RELATED COMPOUND B [USP-RS]
Common Name English
2-CYCLOPENTENE-1-METHANOL, 4-((2,5-DIAMINO-6-CHLORO-4-PYRIMIDINYL)AMINO)-, (1S,4R)-
Systematic Name English
Code System Code Type Description
CAS
141271-12-7
Created by admin on Sat Dec 16 09:22:25 GMT 2023 , Edited by admin on Sat Dec 16 09:22:25 GMT 2023
PRIMARY
EPA CompTox
DTXSID501135192
Created by admin on Sat Dec 16 09:22:25 GMT 2023 , Edited by admin on Sat Dec 16 09:22:25 GMT 2023
PRIMARY
FDA UNII
5JVZ52Q6N8
Created by admin on Sat Dec 16 09:22:25 GMT 2023 , Edited by admin on Sat Dec 16 09:22:25 GMT 2023
PRIMARY
PUBCHEM
11459511
Created by admin on Sat Dec 16 09:22:25 GMT 2023 , Edited by admin on Sat Dec 16 09:22:25 GMT 2023
PRIMARY
RS_ITEM_NUM
1000441
Created by admin on Sat Dec 16 09:22:25 GMT 2023 , Edited by admin on Sat Dec 16 09:22:25 GMT 2023
PRIMARY
NIH
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