DEMETHYL-HYDROXY-EVATANEPAG

Details

Stereochemistry	ACHIRAL
Molecular Formula	C24H26N2O6S
Molecular Weight	470.538
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DEMETHYL-HYDROXY-EVATANEPAG

Structure Search

SMILES

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

InChI

InChIKey=QCKBNFRFJGPPNF-UHFFFAOYSA-N

InChI=1S/C24H26N2O6S/c1-24(2,29)20-10-8-18(9-11-20)15-26(33(30,31)22-7-4-12-25-14-22)16-19-5-3-6-21(13-19)32-17-23(27)28/h3-14,29H,15-17H2,1-2H3,(H,27,28)

HIDE SMILES / InChI

Molecular Formula	C24H26N2O6S
Molecular Weight	470.538
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 `Sat Dec 16 16:34:28 GMT 2023` Edited by `admin` on `Sat Dec 16 16:34:28 GMT 2023`
Record UNII	54SH4M23T6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DEMETHYL-HYDROXY-EVATANEPAG

Common Name

English

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

Systematic Name

English

CP-533,536 METABOLITE M23

Common Name

English

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

Systematic Name

English

Code System Code Type Description

FDA UNII

54SH4M23T6

Created by admin on Sat Dec 16 16:34:28 GMT 2023 , Edited by admin on Sat Dec 16 16:34:28 GMT 2023

PRIMARY

CAS

574759-38-9

Created by admin on Sat Dec 16 16:34:28 GMT 2023 , Edited by admin on Sat Dec 16 16:34:28 GMT 2023

PRIMARY

PUBCHEM

10310827

Created by admin on Sat Dec 16 16:34:28 GMT 2023 , Edited by admin on Sat Dec 16 16:34:28 GMT 2023

PRIMARY

Related Record Type Details


					L266R6E31E

EVATANEPAG

PARENT -> METABOLITE

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