ZILEUTON N-GLUCURONIDE

Details

Stereochemistry	EPIMERIC
Molecular Formula	C17H20N2O8S
Molecular Weight	412.4161
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC([H])(c1cc2ccccc2s1)N(C(=N)O)O[C@@]3([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(C(=O)O)O3)O)O)O

InChI

InChIKey=CYYKQHWQVGZJRJ-UPZRFPAJSA-N

InChI=1S/C17H20N2O8S/c1-7(10-6-8-4-2-3-5-9(8)28-10)19(17(18)25)27-16-13(22)11(20)12(21)14(26-16)15(23)24/h2-7,11-14,16,20-22H,1H3,(H2,18,25)(H,23,24)/t7?,11-,12-,13+,14-,16-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C17H20N2O8S
Molecular Weight	412.4161
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	5 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Jun 26 14:35:04 UTC 2021` Edited by `admin` on `Sat Jun 26 14:35:04 UTC 2021`
Record UNII	LDE6PT2VKH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ZILEUTON N-GLUCURONIDE

Common Name

English

.BETA.-D-GLUCOPYRANURONIC ACID, 1-O-((AMINOCARBONYL)(1-BENZO(B)THIEN-2-YLETHYL)AMINO)-

Systematic Name

English

Code System Code Type Description

CAS

141056-63-5

Created by admin on Sat Jun 26 14:35:04 UTC 2021 , Edited by admin on Sat Jun 26 14:35:04 UTC 2021

PRIMARY

PUBCHEM

71752997

Created by admin on Sat Jun 26 14:35:04 UTC 2021 , Edited by admin on Sat Jun 26 14:35:04 UTC 2021

PRIMARY

FDA UNII

LDE6PT2VKH

Created by admin on Sat Jun 26 14:35:04 UTC 2021 , Edited by admin on Sat Jun 26 14:35:04 UTC 2021

PRIMARY

Related Record Type Details


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ZILEUTON

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