OMEGA-HYDROXY EVATANEPAG

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H28N2O6S
Molecular Weight	484.565
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)(CO)C1=CC=C(CN(CC2=CC=CC(OCC(O)=O)=C2)S(=O)(=O)C3=CN=CC=C3)C=C1

InChI

InChIKey=XKQNMAZMTKTTIA-UHFFFAOYSA-N

InChI=1S/C25H28N2O6S/c1-25(2,18-28)21-10-8-19(9-11-21)15-27(34(31,32)23-7-4-12-26-14-23)16-20-5-3-6-22(13-20)33-17-24(29)30/h3-14,28H,15-18H2,1-2H3,(H,29,30)

HIDE SMILES / InChI

Molecular Formula	C25H28N2O6S
Molecular Weight	484.565
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 08:17:31 GMT 2025` Edited by `admin` on `Wed Apr 02 08:17:31 GMT 2025`
Record UNII	598TY5TBF1
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

OMEGA-HYDROXY EVATANEPAG

Common Name

English

CP-533,536 METABOLITE M4

Preferred Name

English

2-(3-((((4-(2-HYDROXY-1,1-DIMETHYLETHYL)PHENYL)METHYL)(3-PYRIDINYLSULFONYL)AMINO)METHYL)PHENOXY)ACETIC ACID

Systematic Name

English

ACETIC ACID, 2-(3-((((4-(2-HYDROXY-1,1-DIMETHYLETHYL)PHENYL)METHYL)(3-PYRIDINYLSULFONYL)AMINO)METHYL)PHENOXY)-

Systematic Name

English

(3-(((4-(2-HYDROXY-1,1-DIMETHYLETHYL)BENZYL)-N-((PYRIDIN-3-YL)SULFONYL)AMINO)METHYL)PHENOXY)ACETIC ACID

Systematic Name

English

Code System Code Type Description

PUBCHEM

9956982

Created by admin on Wed Apr 02 08:17:31 GMT 2025 , Edited by admin on Wed Apr 02 08:17:31 GMT 2025

PRIMARY

FDA UNII

598TY5TBF1

Created by admin on Wed Apr 02 08:17:31 GMT 2025 , Edited by admin on Wed Apr 02 08:17:31 GMT 2025

PRIMARY

CAS

574759-32-3

Created by admin on Wed Apr 02 08:17:31 GMT 2025 , Edited by admin on Wed Apr 02 08:17:31 GMT 2025

PRIMARY

Related Record Type Details


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EVATANEPAG

PARENT -> METABOLITE

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