3-AZETIDINEPENTANOIC ACID, 1-(3,4-DIFLUORO-2-((2-FLUORO-4-IODOPHENYL)AMINO)BENZOYL)-.DELTA.,3-DIHYDROXY-

Details

Stereochemistry	RACEMIC
Molecular Formula	C21H20F3IN2O5
Molecular Weight	564.2936
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-AZETIDINEPENTANOIC ACID, 1-(3,4-DIFLUORO-2-((2-FLUORO-4-IODOPHENYL)AMINO)BENZOYL)-.DELTA.,3-DIHYDROXY-

Structure Search

SMILES

OC(CCCC(O)=O)C1(O)CN(C1)C(=O)C2=C(NC3=CC=C(I)C=C3F)C(F)=C(F)C=C2

InChI

InChIKey=KGPLBTZFBMHXPQ-UHFFFAOYSA-N

InChI=1S/C21H20F3IN2O5/c22-13-6-5-12(19(18(13)24)26-15-7-4-11(25)8-14(15)23)20(31)27-9-21(32,10-27)16(28)2-1-3-17(29)30/h4-8,16,26,28,32H,1-3,9-10H2,(H,29,30)

HIDE SMILES / InChI

Approval Year

Name

Type

Language

3-AZETIDINEPENTANOIC ACID, 1-(3,4-DIFLUORO-2-((2-FLUORO-4-IODOPHENYL)AMINO)BENZOYL)-.DELTA.,3-DIHYDROXY-

Systematic Name

English

COBIMETINIB METABOLITE M37, M40

Common Name

English

Code System Code Type Description

PUBCHEM

156596518

Created by admin on Sat Dec 16 14:40:04 GMT 2023 , Edited by admin on Sat Dec 16 14:40:04 GMT 2023

PRIMARY

CAS

2171498-56-7

Created by admin on Sat Dec 16 14:40:04 GMT 2023 , Edited by admin on Sat Dec 16 14:40:04 GMT 2023

PRIMARY

FDA UNII

TJS4VN7FAM

Created by admin on Sat Dec 16 14:40:04 GMT 2023 , Edited by admin on Sat Dec 16 14:40:04 GMT 2023

PRIMARY

PARENT (METABOLITE)


					ER29L26N1X

COBIMETINIB

SUBSTANCE RECORD


					TJS4VN7FAM

3-AZETIDINEPENTANOIC ACID, 1-(3,4-DIFLUORO-2-((2-FLUORO-4-IODOPHENYL)AMINO)BENZOYL)-.DELTA.,3-DIHYDROXY-