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

Details

Stereochemistry ABSOLUTE
Molecular Formula C18H23FN4O8
Molecular Weight 442.3956
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PIFLUFOLASTAT

SMILES

OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCNC(=O)C1=CC=C(F)N=C1)C(O)=O)C(O)=O

InChI

InChIKey=OLWVRJUNLXQDSP-RYUDHWBXSA-N
InChI=1S/C18H23FN4O8/c19-13-6-4-10(9-21-13)15(26)20-8-2-1-3-11(16(27)28)22-18(31)23-12(17(29)30)5-7-14(24)25/h4,6,9,11-12H,1-3,5,7-8H2,(H,20,26)(H,24,25)(H,27,28)(H,29,30)(H2,22,23,31)/t11-,12-/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H23FN4O8
Molecular Weight 442.3956
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 05:18:25 GMT 2023
Edited
by admin
on Sat Dec 16 05:18:25 GMT 2023
Record UNII
82VH67YON8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PIFLUFOLASTAT
Common Name English
2-(3-(1-CARBOXY-5-((6-FLUORO-PYRIDINE-3-CARBONYL)-AMINO)-PENTYL)-UREIDO)-PENTANEDIOIC ACID
Systematic Name English
L-GLUTAMIC ACID, N-((((1S)-1-CARBOXY-5-(((6-FLUORO-3-PYRIDINYL)CARBONYL)AMINO)PENTYL)AMINO)CARBONYL)-
Systematic Name English
DCFPYL
Common Name English
Code System Code Type Description
WIKIPEDIA
Piflufolastat F-18
Created by admin on Sat Dec 16 05:18:25 GMT 2023 , Edited by admin on Sat Dec 16 05:18:25 GMT 2023
PRIMARY
EPA CompTox
DTXSID501114097
Created by admin on Sat Dec 16 05:18:25 GMT 2023 , Edited by admin on Sat Dec 16 05:18:25 GMT 2023
PRIMARY
CAS
1423758-00-2
Created by admin on Sat Dec 16 05:18:25 GMT 2023 , Edited by admin on Sat Dec 16 05:18:25 GMT 2023
PRIMARY
SMS_ID
100000175404
Created by admin on Sat Dec 16 05:18:25 GMT 2023 , Edited by admin on Sat Dec 16 05:18:25 GMT 2023
PRIMARY
PUBCHEM
71532123
Created by admin on Sat Dec 16 05:18:25 GMT 2023 , Edited by admin on Sat Dec 16 05:18:25 GMT 2023
PRIMARY
RXCUI
2556617
Created by admin on Sat Dec 16 05:18:25 GMT 2023 , Edited by admin on Sat Dec 16 05:18:25 GMT 2023
PRIMARY
FDA UNII
82VH67YON8
Created by admin on Sat Dec 16 05:18:25 GMT 2023 , Edited by admin on Sat Dec 16 05:18:25 GMT 2023
PRIMARY
EVMPD
SUB189817
Created by admin on Sat Dec 16 05:18:25 GMT 2023 , Edited by admin on Sat Dec 16 05:18:25 GMT 2023
PRIMARY
Related Record Type Details
LABELED -> NON-LABELED