U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C10H13N5O3
Molecular Weight 251.2419
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 9-(3-DEOXY-.BETA.-D-THREO-PENTOFURANOSYL)ADENINE

SMILES

NC1=NC=NC2=C1N=CN2[C@@H]3O[C@H](CO)C[C@@H]3O

InChI

InChIKey=OFEZSBMBBKLLBJ-JFWOZONXSA-N
InChI=1S/C10H13N5O3/c11-8-7-9(13-3-12-8)15(4-14-7)10-6(17)1-5(2-16)18-10/h3-6,10,16-17H,1-2H2,(H2,11,12,13)/t5-,6-,10+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
9-(3-DEOXY-.BETA.-D-THREO-PENTOFURANOSYL)ADENINE
Common Name English
NSC-627047
Preferred Name English
9-(3-DEOXY-.BETA.-D-THREO-PENTOFURANOSYL)-9H-PURIN-6-AMINE
Systematic Name English
ADENINE, 9-(3-DEOXY-.BETA.-D-THREO-PENTOFURANOSYL)-
Systematic Name English
9-(3-DEOXY-.BETA.-D-ARABINOFURANOSYL)ADENINE
Systematic Name English
9H-PURIN-6-AMINE, 9-(3-DEOXY-.BETA.-D-THREO-PENTOFURANOSYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
451875
Created by admin on Tue Apr 01 16:53:03 GMT 2025 , Edited by admin on Tue Apr 01 16:53:03 GMT 2025
PRIMARY
CAS
6998-75-0
Created by admin on Tue Apr 01 16:53:03 GMT 2025 , Edited by admin on Tue Apr 01 16:53:03 GMT 2025
PRIMARY
FDA UNII
K6PKX2PHVZ
Created by admin on Tue Apr 01 16:53:03 GMT 2025 , Edited by admin on Tue Apr 01 16:53:03 GMT 2025
PRIMARY
EPA CompTox
DTXSID20220248
Created by admin on Tue Apr 01 16:53:03 GMT 2025 , Edited by admin on Tue Apr 01 16:53:03 GMT 2025
PRIMARY
NSC
627047
Created by admin on Tue Apr 01 16:53:03 GMT 2025 , Edited by admin on Tue Apr 01 16:53:03 GMT 2025
PRIMARY