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Details

Stereochemistry ACHIRAL
Molecular Formula C23H28N2O3
Molecular Weight 380.48
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CARBOXYFENTANYL

SMILES

OC(=O)CCC(=O)N(C1CCN(CCC2=CC=CC=C2)CC1)C3=CC=CC=C3

InChI

InChIKey=MEVFKTVEGJUHHI-UHFFFAOYSA-N
InChI=1S/C23H28N2O3/c26-22(11-12-23(27)28)25(20-9-5-2-6-10-20)21-14-17-24(18-15-21)16-13-19-7-3-1-4-8-19/h1-10,21H,11-18H2,(H,27,28)

HIDE SMILES / InChI

Molecular Formula C23H28N2O3
Molecular Weight 380.48
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:59:24 GMT 2023
Edited
by admin
on Sat Dec 16 13:59:24 GMT 2023
Record UNII
9B5MX9FN8R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CARBOXYFENTANYL
Common Name English
BUTYRYL FENTANYL CARBOXY METABOLITE
Common Name English
4-OXO-4-(PHENYL(1-(2-PHENYLETHYL)-4-PIPERIDINYL)AMINO)BUTANOIC ACID
Systematic Name English
BUTANOIC ACID, 4-OXO-4-(PHENYL(1-(2-PHENYLETHYL)-4-PIPERIDINYL)AMINO)-
Systematic Name English
Code System Code Type Description
PUBCHEM
23635044
Created by admin on Sat Dec 16 13:59:24 GMT 2023 , Edited by admin on Sat Dec 16 13:59:24 GMT 2023
PRIMARY
EPA CompTox
DTXSID501037401
Created by admin on Sat Dec 16 13:59:24 GMT 2023 , Edited by admin on Sat Dec 16 13:59:24 GMT 2023
PRIMARY
FDA UNII
9B5MX9FN8R
Created by admin on Sat Dec 16 13:59:24 GMT 2023 , Edited by admin on Sat Dec 16 13:59:24 GMT 2023
PRIMARY
CAS
52994-23-7
Created by admin on Sat Dec 16 13:59:24 GMT 2023 , Edited by admin on Sat Dec 16 13:59:24 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
BINDING
IC50