(4-(2-(((2R)-2-HYDROXY-2-(6-HYDROXY-3-OXO-4H-1,4-BENZOXAZIN-8-YL)ETHYL)AMINO)-2-METHYL-PROPYL)PHENYL) HYDROGEN SULFATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H24N2O8S
Molecular Weight	452.478
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (4-(2-(((2R)-2-HYDROXY-2-(6-HYDROXY-3-OXO-4H-1,4-BENZOXAZIN-8-YL)ETHYL)AMINO)-2-METHYL-PROPYL)PHENYL) HYDROGEN SULFATE

Structure Search

SMILES

CC(C)(CC1=CC=C(OS(O)(=O)=O)C=C1)NC[C@H](O)C2=C3OCC(=O)NC3=CC(O)=C2

InChI

InChIKey=WFWBNMBOJMUVDA-KRWDZBQOSA-N

InChI=1S/C20H24N2O8S/c1-20(2,9-12-3-5-14(6-4-12)30-31(26,27)28)21-10-17(24)15-7-13(23)8-16-19(15)29-11-18(25)22-16/h3-8,17,21,23-24H,9-11H2,1-2H3,(H,22,25)(H,26,27,28)/t17-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H24N2O8S
Molecular Weight	452.478
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 12:07:57 GMT 2025` Edited by `admin` on `Wed Apr 02 12:07:57 GMT 2025`
Record UNII	2NL5LG9LU4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CD12656

Preferred Name

English

(4-(2-(((2R)-2-HYDROXY-2-(6-HYDROXY-3-OXO-4H-1,4-BENZOXAZIN-8-YL)ETHYL)AMINO)-2-METHYL-PROPYL)PHENYL) HYDROGEN SULFATE

Systematic Name

English

OLODATEROL METABOLITE M455(1)

Common Name

English

Code System Code Type Description

FDA UNII

2NL5LG9LU4

Created by admin on Wed Apr 02 12:07:57 GMT 2025 , Edited by admin on Wed Apr 02 12:07:57 GMT 2025

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PUBCHEM

155929120

Created by admin on Wed Apr 02 12:07:57 GMT 2025 , Edited by admin on Wed Apr 02 12:07:57 GMT 2025

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Related Record Type Details


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OLODATEROL

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