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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H16FN3O6
Molecular Weight 329.281
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2',3'-DI-O-ACETYL-5'-DEOXY-5-FLUOROCYTIDINE

SMILES

C[C@H]1O[C@H]([C@H](OC(C)=O)[C@@H]1OC(C)=O)N2C=C(F)C(N)=NC2=O

InChI

InChIKey=NWJBWNIUGNXJGO-RPULLILYSA-N
InChI=1S/C13H16FN3O6/c1-5-9(22-6(2)18)10(23-7(3)19)12(21-5)17-4-8(14)11(15)16-13(17)20/h4-5,9-10,12H,1-3H3,(H2,15,16,20)/t5-,9-,10-,12-/m1/s1

HIDE SMILES / InChI

Molecular Formula C13H16FN3O6
Molecular Weight 329.281
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Thu Jul 06 11:32:23 UTC 2023
Edited
by admin
on Thu Jul 06 11:32:23 UTC 2023
Record UNII
Q6KTK8KQR2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2',3'-DI-O-ACETYL-5'-DEOXY-5-FLUOROCYTIDINE
Systematic Name English
5'-DEOXY-2',3'-DI-O-ACETYL-5-FLUOROCYTIDINE
Systematic Name English
CYTIDINE, 5'-DEOXY-5-FLUORO-, 2',3'-DIACETATE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID40167207
Created by admin on Thu Jul 06 11:32:23 UTC 2023 , Edited by admin on Thu Jul 06 11:32:23 UTC 2023
PRIMARY
CAS
161599-46-8
Created by admin on Thu Jul 06 11:32:23 UTC 2023 , Edited by admin on Thu Jul 06 11:32:23 UTC 2023
PRIMARY
CHEBI
83538
Created by admin on Thu Jul 06 11:32:23 UTC 2023 , Edited by admin on Thu Jul 06 11:32:23 UTC 2023
PRIMARY
PUBCHEM
11809635
Created by admin on Thu Jul 06 11:32:23 UTC 2023 , Edited by admin on Thu Jul 06 11:32:23 UTC 2023
PRIMARY
FDA UNII
Q6KTK8KQR2
Created by admin on Thu Jul 06 11:32:23 UTC 2023 , Edited by admin on Thu Jul 06 11:32:23 UTC 2023
PRIMARY
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