5-((1S)-2-((5-ETHYL-6-(1-HYDROXYETHYL)INDAN-2-YL)AMINO)-1-HYDROXY-ETHYL)-8-HYDROXY-1H-QUINOLIN-2-ONE

Details

Stereochemistry	MIXED
Molecular Formula	C24H28N2O4
Molecular Weight	408.4901
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-((1S)-2-((5-ETHYL-6-(1-HYDROXYETHYL)INDAN-2-YL)AMINO)-1-HYDROXY-ETHYL)-8-HYDROXY-1H-QUINOLIN-2-ONE

Structure Search

SMILES

CCC1=CC2=C(CC(C2)NC[C@@H](O)C3=CC=C(O)C4=C3C=CC(=O)N4)C=C1C(C)O

InChI

InChIKey=DHOVNAABCPYSTQ-USPTVAFNSA-N

InChI=1S/C24H28N2O4/c1-3-14-8-15-9-17(10-16(15)11-20(14)13(2)27)25-12-22(29)18-4-6-21(28)24-19(18)5-7-23(30)26-24/h4-8,11,13,17,22,25,27-29H,3,9-10,12H2,1-2H3,(H,26,30)/t13?,17?,22-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H28N2O4
Molecular Weight	408.4901
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	1 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 10:41:20 GMT 2025` Edited by `admin` on `Wed Apr 02 10:41:20 GMT 2025`
Record UNII	Z4R6HF3AU3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

INDACATEROL METABOLITE P30.3

Preferred Name

English

5-((1S)-2-((5-ETHYL-6-(1-HYDROXYETHYL)INDAN-2-YL)AMINO)-1-HYDROXY-ETHYL)-8-HYDROXY-1H-QUINOLIN-2-ONE

Systematic Name

English

Code System Code Type Description

PUBCHEM

156613533

Created by admin on Wed Apr 02 10:41:20 GMT 2025 , Edited by admin on Wed Apr 02 10:41:20 GMT 2025

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FDA UNII

Z4R6HF3AU3

Created by admin on Wed Apr 02 10:41:20 GMT 2025 , Edited by admin on Wed Apr 02 10:41:20 GMT 2025

PRIMARY

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INDACATEROL

PARENT -> METABOLITE

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