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Details

Stereochemistry ACHIRAL
Molecular Formula C20H21F3N2O
Molecular Weight 362.3887
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 9-(4-AMINOBUTYL)-N-(2,2,2-TRIFLUOROETHYL)-9H-FLUORENE-9-CARBOXAMIDE

SMILES

NCCCCC1(C(=O)NCC(F)(F)F)C2=CC=CC=C2C3=C1C=CC=C3

InChI

InChIKey=KWBNLWHIEGZSFP-UHFFFAOYSA-N
InChI=1S/C20H21F3N2O/c21-20(22,23)13-25-18(26)19(11-5-6-12-24)16-9-3-1-7-14(16)15-8-2-4-10-17(15)19/h1-4,7-10H,5-6,11-13,24H2,(H,25,26)

HIDE SMILES / InChI

Molecular Formula C20H21F3N2O
Molecular Weight 362.3887
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Oct 21 22:08:38 UTC 2019
Edited
by admin
on Mon Oct 21 22:08:38 UTC 2019
Record UNII
4KS2U1L413
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
9-(4-AMINOBUTYL)-N-(2,2,2-TRIFLUOROETHYL)-9H-FLUORENE-9-CARBOXAMIDE
Systematic Name English
9H-FLUORENE-9-CARBOXAMIDE, 9-(4-AMINOBUTYL)-N-(2,2,2-TRIFLUOROETHYL)-
Systematic Name English
LOMITAPIDE METABOLITE M5
Common Name English
Code System Code Type Description
CAS
199670-06-9
Created by admin on Mon Oct 21 22:08:38 UTC 2019 , Edited by admin on Mon Oct 21 22:08:38 UTC 2019
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
In plasma, M5 was the prominent metabolite that accounted for 4.26% of the total radioactivity in 0 €“ 24 hours plasma samples. In urine, M5 was the prominent metabolite that accounted for 3.47% of the dose in the 0 €“96 hours urine samples. In feces, M5 was the minor metabolite that accounted for 0.78% of the dose in the 0 €“ 96 hours feces.
FECAL; PLASMA; URINE