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

Details

Stereochemistry ABSOLUTE
Molecular Formula C25H26FN3O5
Molecular Weight 467.4894
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FIRUGLIPEL

SMILES

CC[C@@H](OC1=CC=C(C=C1)C(=O)C2CC2)C3=NC(=NO3)C4=CC=C(C(=O)N[C@H](C)CO)C(F)=C4

InChI

InChIKey=LRXRIKVDAVVQCP-SPLOXXLWSA-N
InChI=1S/C25H26FN3O5/c1-3-21(33-18-9-6-16(7-10-18)22(31)15-4-5-15)25-28-23(29-34-25)17-8-11-19(20(26)12-17)24(32)27-14(2)13-30/h6-12,14-15,21,30H,3-5,13H2,1-2H3,(H,27,32)/t14-,21-/m1/s1

HIDE SMILES / InChI

Molecular Formula C25H26FN3O5
Molecular Weight 467.4894
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 09:17:17 GMT 2023
Edited
by admin
on Sat Dec 16 09:17:17 GMT 2023
Record UNII
08P99TX229
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FIRUGLIPEL
INN  
INN  
Official Name English
firuglipel [INN]
Common Name English
DS-8500A
Code English
4-(5-((1R)-1-(4-(CYCLOPROPANECARBONYL)PHENOXY)PROPYL)-1,2,4-OXADIAZOL-3-YL)-2-FLUORO-N-((2R)-1-HYDROXYPROPAN-2-YL)BENZAMIDE
Systematic Name English
BENZAMIDE, 4-(5-((1R)-1-(4-(CYCLOPROPYLCARBONYL)PHENOXY)PROPYL)-1,2,4-OXADIAZOL-3-YL)-2-FLUORO-N-((1R)-2-HYDROXY-1-METHYLETHYL)-
Systematic Name English
Code System Code Type Description
CAS
1371591-51-3
Created by admin on Sat Dec 16 09:17:17 GMT 2023 , Edited by admin on Sat Dec 16 09:17:17 GMT 2023
PRIMARY
NCI_THESAURUS
C171711
Created by admin on Sat Dec 16 09:17:17 GMT 2023 , Edited by admin on Sat Dec 16 09:17:17 GMT 2023
PRIMARY
SMS_ID
300000036964
Created by admin on Sat Dec 16 09:17:17 GMT 2023 , Edited by admin on Sat Dec 16 09:17:17 GMT 2023
PRIMARY
FDA UNII
08P99TX229
Created by admin on Sat Dec 16 09:17:17 GMT 2023 , Edited by admin on Sat Dec 16 09:17:17 GMT 2023
PRIMARY
PUBCHEM
56959560
Created by admin on Sat Dec 16 09:17:17 GMT 2023 , Edited by admin on Sat Dec 16 09:17:17 GMT 2023
PRIMARY
INN
10466
Created by admin on Sat Dec 16 09:17:17 GMT 2023 , Edited by admin on Sat Dec 16 09:17:17 GMT 2023
PRIMARY
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ACTIVE MOIETY