N-FORMYLVARENICLINE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H13N3O
Molecular Weight	239.2725
Optical Activity	NONE
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O=CN1C[C@@H]2C[C@H](C1)C3=C2C=C4N=CC=NC4=C3

InChI

InChIKey=WFXWKRXICPYTSW-AOOOYVTPSA-N

InChI=1S/C14H13N3O/c18-8-17-6-9-3-10(7-17)12-5-14-13(4-11(9)12)15-1-2-16-14/h1-2,4-5,8-10H,3,6-7H2/t9-,10+

HIDE SMILES / InChI

Molecular Formula	C14H13N3O
Molecular Weight	239.2725
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 `Wed Apr 02 00:19:25 GMT 2025` Edited by `admin` on `Wed Apr 02 00:19:25 GMT 2025`
Record UNII	DCP9JBZ34N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CP-697,535

Preferred Name

English

N-FORMYLVARENICLINE

Common Name

English

6,7,9,10-TETRAHYDRO-6,10-METHANO-8H-PYRAZINO(2,3-H)(3)BENZAZEPINE-8-CARBOXALDEHYDE

Systematic Name

English

VARENICLINE METABOLITE M5

Common Name

English

6,10-METHANO-8H-PYRAZINO(2,3-H)(3)BENZAZEPINE-8-CARBOXALDEHYDE, 6,7,9,10-TETRAHYDRO-

Systematic Name

English

Code System Code Type Description

PUBCHEM

29980534

Created by admin on Wed Apr 02 00:19:25 GMT 2025 , Edited by admin on Wed Apr 02 00:19:25 GMT 2025

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CAS

796865-82-2

Created by admin on Wed Apr 02 00:19:25 GMT 2025 , Edited by admin on Wed Apr 02 00:19:25 GMT 2025

PRIMARY

FDA UNII

DCP9JBZ34N

Created by admin on Wed Apr 02 00:19:25 GMT 2025 , Edited by admin on Wed Apr 02 00:19:25 GMT 2025

PRIMARY

EPA CompTox

DTXSID30437901

Created by admin on Wed Apr 02 00:19:25 GMT 2025 , Edited by admin on Wed Apr 02 00:19:25 GMT 2025

PRIMARY

Related Record Type Details


					W6HS99O8ZO

VARENICLINE

PARENT -> METABOLITE

Amount: