BICIFADINE LACTAM

Details

Stereochemistry	RACEMIC
Molecular Formula	C12H13NO
Molecular Weight	187.2377
Optical Activity	( + / - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12C[C@]1(CNC2=O)C3=CC=C(C)C=C3

InChI

InChIKey=QZNYFUDMBZDGHX-PWSUYJOCSA-N

InChI=1S/C12H13NO/c1-8-2-4-9(5-3-8)12-6-10(12)11(14)13-7-12/h2-5,10H,6-7H2,1H3,(H,13,14)/t10-,12+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C12H13NO
Molecular Weight	187.2377
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 15:41:09 GMT 2023` Edited by `admin` on `Sat Dec 16 15:41:09 GMT 2023`
Record UNII	R23IU83EOL
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BICIFADINE LACTAM

Common Name

English

BICIFADINE METABOLITE M12

Common Name

English

3-AZABICYCLO(3.1.0)HEXAN-2-ONE, 5-(4-METHYLPHENYL)-

Systematic Name

English

5-(4-METHYLPHENYL)-3-AZABICYCLO(3.1.0)HEXAN-2-ONE

Systematic Name

English

Code System Code Type Description

FDA UNII

R23IU83EOL

Created by admin on Sat Dec 16 15:41:09 GMT 2023 , Edited by admin on Sat Dec 16 15:41:09 GMT 2023

PRIMARY

CAS

909396-95-8

Created by admin on Sat Dec 16 15:41:09 GMT 2023 , Edited by admin on Sat Dec 16 15:41:09 GMT 2023

PRIMARY

PUBCHEM

69632526

Created by admin on Sat Dec 16 15:41:09 GMT 2023 , Edited by admin on Sat Dec 16 15:41:09 GMT 2023

PRIMARY

Related Record Type Details


					B0SV3N7J3H

BICIFADINE

PARENT -> METABOLITE

Comments:

Neither unchanged bicifadine nor M12 were detected in urine or feces

Interaction Type:

MAJOR

Qualification:

PLASMA

Name	Property Type	Amount	Referenced Substance	Defining	Parameters	References
Tmax	PHARMACOKINETIC