EDARAVONE GLUCURONIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H18N2O7
Molecular Weight	350.3233
Optical Activity	( - )
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=NN(C(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)=C1)C3=CC=CC=C3

InChI

InChIKey=KZSVPEVBRMCCMG-JHZZJYKESA-N

InChI=1S/C16H18N2O7/c1-8-7-10(18(17-8)9-5-3-2-4-6-9)24-16-13(21)11(19)12(20)14(25-16)15(22)23/h2-7,11-14,16,19-21H,1H3,(H,22,23)/t11-,12-,13+,14-,16+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C16H18N2O7
Molecular Weight	350.3233
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Oct 22 14:05:34 UTC 2019` Edited by `admin` on `Tue Oct 22 14:05:34 UTC 2019`
Record UNII	8H49YKB263
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

EDARAVONE GLUCURONIDE

Common Name

English

NORANTIPYRINE GLUCURONIDE

Common Name

English

.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 3-METHYL-1-PHENYL-1H-PYRAZOL-5-YL

Systematic Name

English

MCI 186 GLUCURONIDE

Code

English

3-METHYL-1-PHENYL-1H-PYRAZOL-5-YL .BETA.-D-GLUCOPYRANOSIDURONIC ACID

Systematic Name

English

Code System Code Type Description

EPA CompTox

67566-02-3

Created by admin on Tue Oct 22 14:05:35 UTC 2019 , Edited by admin on Tue Oct 22 14:05:35 UTC 2019

PRIMARY

CAS

67566-02-3

Created by admin on Tue Oct 22 14:05:35 UTC 2019 , Edited by admin on Tue Oct 22 14:05:35 UTC 2019

NON-SPECIFIC STOICHIOMETRY

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EDARAVONE

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