U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C31H33F3N2O5S
Molecular Weight 604.657
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TIPRANAVIR C-14

SMILES

CCC[C@@]2(CCC1=CC=CC=C1)CC(O)=C([14C@H](CC)C3=CC=CC(NS(=O)(=O)C4=NC=C(C=C4)C(F)(F)F)=C3)C(=O)O2

InChI

InChIKey=SUJUHGSWHZTSEU-MWQIXQBFSA-N
InChI=1S/C31H33F3N2O5S/c1-3-16-30(17-15-21-9-6-5-7-10-21)19-26(37)28(29(38)41-30)25(4-2)22-11-8-12-24(18-22)36-42(39,40)27-14-13-23(20-35-27)31(32,33)34/h5-14,18,20,25,36-37H,3-4,15-17,19H2,1-2H3/t25-,30-/m1/s1/i25+2

HIDE SMILES / InChI

Molecular Formula C31H33F3N2O5S
Molecular Weight 604.657
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 14:46:49 GMT 2023
Edited
by admin
on Sat Dec 16 14:46:49 GMT 2023
Record UNII
VU8T5RB4VW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TIPRANAVIR C-14
Common Name English
2-PYRIDINESULFONAMIDE, N-(3-((1R)-1-((6R)-5,6-DIHYDRO-4-HYDROXY-2-OXO-6-(2-PHENYLETHYL)-6-PROPYL-2H-PYRAN-3-YL)PROPYL-1-14C)PHENYL)-5-(TRIFLUOROMETHYL)-
Systematic Name English
14C-TIPRANAVIR
Common Name English
Code System Code Type Description
CAS
1141509-98-9
Created by admin on Sat Dec 16 14:46:49 GMT 2023 , Edited by admin on Sat Dec 16 14:46:49 GMT 2023
PRIMARY
PUBCHEM
54728557
Created by admin on Sat Dec 16 14:46:49 GMT 2023 , Edited by admin on Sat Dec 16 14:46:49 GMT 2023
PRIMARY
DRUG BANK
DB15108
Created by admin on Sat Dec 16 14:46:49 GMT 2023 , Edited by admin on Sat Dec 16 14:46:49 GMT 2023
PRIMARY
FDA UNII
VU8T5RB4VW
Created by admin on Sat Dec 16 14:46:49 GMT 2023 , Edited by admin on Sat Dec 16 14:46:49 GMT 2023
PRIMARY