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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H32F3N5O5
Molecular Weight 515.5259
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PF-07329266

SMILES

[H][C@]12CN([C@H](C(=O)N[C@@H](C[C@@H]3CCNC3=O)C#N)[C@@]1([H])[C@@]2(C)CO)C(=O)[C@@H](NC(=O)C(F)(F)F)C(C)(C)C

InChI

InChIKey=CUEGVRNFVNRCFT-ZMGIYNICSA-N
InChI=1S/C23H32F3N5O5/c1-21(2,3)16(30-20(36)23(24,25)26)19(35)31-9-13-14(22(13,4)10-32)15(31)18(34)29-12(8-27)7-11-5-6-28-17(11)33/h11-16,32H,5-7,9-10H2,1-4H3,(H,28,33)(H,29,34)(H,30,36)/t11-,12-,13-,14-,15-,16+,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C23H32F3N5O5
Molecular Weight 515.5259
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Jul 07 00:38:30 UTC 2023
Edited
by admin
on Fri Jul 07 00:38:30 UTC 2023
Record UNII
NMW2V4PD8G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PF-07329266
Code English
3-Azabicyclo[3.1.0]hexane-2-carboxamide, N-[(1S)-1-cyano-2-[(3S)-2-oxo-3-pyrrolidinyl]ethyl]-3-[(2S)-3,3-dimethyl-1-oxo-2-[(2,2,2-trifluoroacetyl)amino]butyl]-6-(hydroxymethyl)-6-methyl-, (1R,2S,5S,6S)-
Systematic Name English
Nirmatrelvir Metabolite M2
Common Name English
Code System Code Type Description
CAS
2755812-09-8
Created by admin on Fri Jul 07 00:38:30 UTC 2023 , Edited by admin on Fri Jul 07 00:38:30 UTC 2023
PRIMARY
PUBCHEM
162396446
Created by admin on Fri Jul 07 00:38:30 UTC 2023 , Edited by admin on Fri Jul 07 00:38:30 UTC 2023
PRIMARY
FDA UNII
NMW2V4PD8G
Created by admin on Fri Jul 07 00:38:30 UTC 2023 , Edited by admin on Fri Jul 07 00:38:30 UTC 2023
PRIMARY
Related Record Type Details
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