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Details

Stereochemistry ABSOLUTE
Molecular Formula C8H11N3O3S
Molecular Weight 229.256
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of APRICITABINE, (+)-

SMILES

NC1=NC(=O)N(C=C1)[C@@H]2CO[C@H](CO)S2

InChI

InChIKey=RYMCFYKJDVMSIR-BQBZGAKWSA-N
InChI=1S/C8H11N3O3S/c9-5-1-2-11(8(13)10-5)6-4-14-7(3-12)15-6/h1-2,6-7,12H,3-4H2,(H2,9,10,13)/t6-,7-/m0/s1

HIDE SMILES / InChI

Molecular Formula C8H11N3O3S
Molecular Weight 229.256
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 16:53:55 UTC 2023
Edited
by admin
on Sat Dec 16 16:53:55 UTC 2023
Record UNII
V37NC3HC33
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
APRICITABINE, (+)-
Common Name English
2'-DEOXY-3'-OXA-4'-THIOCYTIDINE, CIS-(+)-
Common Name English
BCH-10652, (+)-
Code English
BCH 10619
Code English
(+)-DOTC
Common Name English
2(1H)-PYRIMIDINONE, 4-AMINO-1-((2S,4S)-2-(HYDROXYMETHYL)-1,3-OXATHIOLAN-4-YL)-
Systematic Name English
2(1H)-PYRIMIDINONE, 4-AMINO-1-(2-(HYDROXYMETHYL)-1,3-OXATHIOLAN-4-YL)-, (2S-CIS)-
Systematic Name English
DOTC, CIS-(+)-
Common Name English
Code System Code Type Description
FDA UNII
V37NC3HC33
Created by admin on Sat Dec 16 16:53:55 UTC 2023 , Edited by admin on Sat Dec 16 16:53:55 UTC 2023
PRIMARY
EPA CompTox
DTXSID001031208
Created by admin on Sat Dec 16 16:53:55 UTC 2023 , Edited by admin on Sat Dec 16 16:53:55 UTC 2023
PRIMARY
PUBCHEM
468214
Created by admin on Sat Dec 16 16:53:55 UTC 2023 , Edited by admin on Sat Dec 16 16:53:55 UTC 2023
PRIMARY
CAS
160707-68-6
Created by admin on Sat Dec 16 16:53:55 UTC 2023 , Edited by admin on Sat Dec 16 16:53:55 UTC 2023
PRIMARY
Related Record Type Details
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