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

Details

Stereochemistry ABSOLUTE
Molecular Formula C29H25NO3
Molecular Weight 435.5137
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(1-OXO-4-(1-PYRENYL)BUTYL)-L-PHENYLALANINE

SMILES

OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CCCC2=C3C=CC4=CC=CC5=C4C3=C(C=C2)C=C5

InChI

InChIKey=DPTMGBIKSPWCNS-VWLOTQADSA-N
InChI=1S/C29H25NO3/c31-26(30-25(29(32)33)18-19-6-2-1-3-7-19)11-5-8-20-12-13-23-15-14-21-9-4-10-22-16-17-24(20)28(23)27(21)22/h1-4,6-7,9-10,12-17,25H,5,8,11,18H2,(H,30,31)(H,32,33)/t25-/m0/s1

HIDE SMILES / InChI

Molecular Formula C29H25NO3
Molecular Weight 435.5137
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
FTIR spectroscopic study on the interaction between a fluoroionophore and metal ions.
2007-07
Structural and orientational studies of chiral N-[4(1-pyrene)butyroyl]-phenylalanine in cast film.
2005-09
Substance Class Chemical
Created
by admin
on Mon Mar 31 23:03:33 GMT 2025
Edited
by admin
on Mon Mar 31 23:03:33 GMT 2025
Record UNII
7U77MPQ0M2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PY-PHE
MI  
Preferred Name English
N-(1-OXO-4-(1-PYRENYL)BUTYL)-L-PHENYLALANINE
Systematic Name English
PY-PHE [MI]
Common Name English
N-(1-PHENYLALANINE)-4-(1-PYRENE)BUTYRAMIDE
Systematic Name English
Code System Code Type Description
FDA UNII
7U77MPQ0M2
Created by admin on Mon Mar 31 23:03:33 GMT 2025 , Edited by admin on Mon Mar 31 23:03:33 GMT 2025
PRIMARY
CAS
199612-75-4
Created by admin on Mon Mar 31 23:03:33 GMT 2025 , Edited by admin on Mon Mar 31 23:03:33 GMT 2025
PRIMARY
MERCK INDEX
m9333
Created by admin on Mon Mar 31 23:03:33 GMT 2025 , Edited by admin on Mon Mar 31 23:03:33 GMT 2025
PRIMARY Merck Index
EPA CompTox
DTXSID10601961
Created by admin on Mon Mar 31 23:03:33 GMT 2025 , Edited by admin on Mon Mar 31 23:03:33 GMT 2025
PRIMARY
PUBCHEM
20055248
Created by admin on Mon Mar 31 23:03:33 GMT 2025 , Edited by admin on Mon Mar 31 23:03:33 GMT 2025
PRIMARY