6-HYDROXYCHLORZOXAZONE GLUCURONIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C13H12ClNO9
Molecular Weight	361.6891
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 6-HYDROXYCHLORZOXAZONE GLUCURONIDE

Structure Search

SMILES

c1c(c(cc2c1nc(O)o2)O[C@@]3([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(C(=O)O)O3)O)O)O)Cl

InChI

InChIKey=FECWRMCLWLJFHA-GOVZDWNOSA-N

InChI=1S/C13H12ClNO9/c14-3-1-4-6(23-13(21)15-4)2-5(3)22-12-9(18)7(16)8(17)10(24-12)11(19)20/h1-2,7-10,12,16-18H,(H,15,21)(H,19,20)/t7-,8-,9+,10-,12+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C13H12ClNO9
Molecular Weight	361.6891
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Jun 26 13:40:50 UTC 2021` Edited by `admin` on `Sat Jun 26 13:40:50 UTC 2021`
Record UNII	HCL8UQ2CG0
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

6-HYDROXYCHLORZOXAZONE GLUCURONIDE

Common Name

English

.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 5-CHLORO-2,3-DIHYDRO-2-OXO-6-BENZOXAZOLYL

Systematic Name

English

Code System Code Type Description

FDA UNII

HCL8UQ2CG0

Created by admin on Sat Jun 26 13:40:50 UTC 2021 , Edited by admin on Sat Jun 26 13:40:50 UTC 2021

PRIMARY

CAS

87620-03-9

Created by admin on Sat Jun 26 13:40:50 UTC 2021 , Edited by admin on Sat Jun 26 13:40:50 UTC 2021

PRIMARY

PUBCHEM

129522086

Created by admin on Sat Jun 26 13:40:50 UTC 2021 , Edited by admin on Sat Jun 26 13:40:50 UTC 2021

PRIMARY

Related Record Type Details


					H0DE420U8G

CHLORZOXAZONE

PARENT -> METABOLITE INACTIVE