ERLORTINIB HEPATOTOXIC GUINONEIMINE

COCCOC1=C(OCCOC)C=C2C(=C1)N=CN=C2\N=C3\C=CC(=O)C(=C3)C#C

InChIKey=NZKODLGRMXYYIO-XYGWBWBKSA-N

InChI=1S/C22H21N3O5/c1-4-15-11-16(5-6-19(15)26)25-22-17-12-20(29-9-7-27-2)21(30-10-8-28-3)13-18(17)23-14-24-22/h1,5-6,11-14H,7-10H2,2-3H3/b25-16-

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:06:00 UTC 2023` Edited by `admin` on `Sat Dec 16 15:06:00 UTC 2023`
Record UNII	8WJW95YV4U
Record Status	`Validated (UNII)`
Record Version

Name

Type

Language

ERLORTINIB HEPATOTOXIC GUINONEIMINE

Common Name

English

(4Z)-4-(6,7-BIS(2-METHOXYETHOXY)QUINAZOLIN-4-YL)IMINO-2-ETHYNYL-CYCLOHEXA-2,5-DIEN-1-ONE

Systematic Name

English

Code System Code Type Description

FDA UNII

8WJW95YV4U

Created by admin on Sat Dec 16 15:06:01 UTC 2023 , Edited by admin on Sat Dec 16 15:06:01 UTC 2023

PRIMARY

Related Record Type Details


					J4T82NDH7E

PARENT -> METABOLITE

Comments:

Mediated thru CYP3A4/1A1 and produced thru aromatic hydroxylation.