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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H12N4O4
Molecular Weight 252.2267
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 9-(2-Deoxy-?-D-erythro-pentofuranosyl)-1,9-dihydro-6H-purin-6-one

SMILES

OC[C@H]1O[C@@H](C[C@@H]1O)N2C=NC3=C2N=CNC3=O

InChI

InChIKey=VGONTNSXDCQUGY-XVMARJQXSA-N
InChI=1S/C10H12N4O4/c15-2-6-5(16)1-7(18-6)14-4-13-8-9(14)11-3-12-10(8)17/h3-7,15-16H,1-2H2,(H,11,12,17)/t5-,6+,7-/m0/s1

HIDE SMILES / InChI

Molecular Formula C10H12N4O4
Molecular Weight 252.2267
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 Mon Mar 31 22:44:08 GMT 2025
Edited
by admin
on Mon Mar 31 22:44:08 GMT 2025
Record UNII
U15W6SC28G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6H-Purin-6-one, 9-(2-deoxy-?-D-erythro-pentofuranosyl)-1,9-dihydro-
Preferred Name English
9-(2-Deoxy-?-D-erythro-pentofuranosyl)-1,9-dihydro-6H-purin-6-one
Systematic Name English
Code System Code Type Description
CAS
84828-85-3
Created by admin on Mon Mar 31 22:44:08 GMT 2025 , Edited by admin on Mon Mar 31 22:44:08 GMT 2025
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FDA UNII
U15W6SC28G
Created by admin on Mon Mar 31 22:44:08 GMT 2025 , Edited by admin on Mon Mar 31 22:44:08 GMT 2025
PRIMARY
EPA CompTox
DTXSID10862459
Created by admin on Mon Mar 31 22:44:08 GMT 2025 , Edited by admin on Mon Mar 31 22:44:08 GMT 2025
PRIMARY
PUBCHEM
135921221
Created by admin on Mon Mar 31 22:44:08 GMT 2025 , Edited by admin on Mon Mar 31 22:44:08 GMT 2025
PRIMARY