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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H31N6O8P
Molecular Weight 526.48
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Des-phenyl-remdesivir

SMILES

CCC(CC)COC(=O)[C@H](C)NP(O)(=O)OC[C@H]1O[C@](C#N)([C@H](O)[C@@H]1O)C2=CC=C3N2N=CN=C3N

InChI

InChIKey=HYPRGHOYFMDFNG-KOHYREPUSA-N
InChI=1S/C21H31N6O8P/c1-4-13(5-2)8-33-20(30)12(3)26-36(31,32)34-9-15-17(28)18(29)21(10-22,35-15)16-7-6-14-19(23)24-11-25-27(14)16/h6-7,11-13,15,17-18,28-29H,4-5,8-9H2,1-3H3,(H2,23,24,25)(H2,26,31,32)/t12-,15+,17+,18+,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H31N6O8P
Molecular Weight 526.48
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:15:20 GMT 2023
Edited
by admin
on Sat Dec 16 19:15:20 GMT 2023
Record UNII
3W3LMG67VX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Des-phenyl-remdesivir
Common Name English
2-ethylbutyl ((R)-(((2R,3S,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)-L-alaninate
Systematic Name English
Code System Code Type Description
CAS
2768006-90-0
Created by admin on Sat Dec 16 19:15:20 GMT 2023 , Edited by admin on Sat Dec 16 19:15:20 GMT 2023
PRIMARY
PUBCHEM
164512912
Created by admin on Sat Dec 16 19:15:20 GMT 2023 , Edited by admin on Sat Dec 16 19:15:20 GMT 2023
PRIMARY
FDA UNII
3W3LMG67VX
Created by admin on Sat Dec 16 19:15:20 GMT 2023 , Edited by admin on Sat Dec 16 19:15:20 GMT 2023
PRIMARY
Name Property Type Amount Referenced Substance Defining Parameters References
Blood-to-plasma ratio PHARMACOKINETIC
Biological Half-life PHARMACOKINETIC
Tmax PHARMACOKINETIC