6-O-GLUCURONIDE-TRICLOCARBAN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H17Cl3N2O8
Molecular Weight	507.706
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 6-O-GLUCURONIDE-TRICLOCARBAN

Structure Search

SMILES

O[C@@H]1[C@@H](O)[C@H](OC2=C(NC(=O)NC3=CC=C(Cl)C=C3)C=C(Cl)C(Cl)=C2)O[C@@H]([C@H]1O)C(O)=O

InChI

InChIKey=XZHQVDPNCJWGLS-RNGZQALNSA-N

InChI=1S/C19H17Cl3N2O8/c20-7-1-3-8(4-2-7)23-19(30)24-11-5-9(21)10(22)6-12(11)31-18-15(27)13(25)14(26)16(32-18)17(28)29/h1-6,13-16,18,25-27H,(H,28,29)(H2,23,24,30)/t13-,14-,15+,16-,18+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C19H17Cl3N2O8
Molecular Weight	507.706
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 Dec 16 18:02:20 UTC 2023` Edited by `admin` on `Sat Dec 16 18:02:20 UTC 2023`
Record UNII	6U9Y4LH88T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

6-O-GLUCURONIDE-TRICLOCARBAN

Common Name

English

.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 4,5-DICHLORO-2-((((4-CHLOROPHENYL)AMINO)CARBONYL)AMINO)PHENYL

Systematic Name

English

6-HYDROXY-3,4,4'-TRICHLOROCARBANILIDE GLUCURONIDE

Common Name

English

4,5-DICHLORO-2-((((4-CHLOROPHENYL)AMINO)CARBONYL)AMINO)PHENYL .BETA.-D-GLUCOPYRANOSIDURONIC ACID

Systematic Name

English

Code System Code Type Description

FDA UNII

6U9Y4LH88T

Created by admin on Sat Dec 16 18:02:20 UTC 2023 , Edited by admin on Sat Dec 16 18:02:20 UTC 2023

PRIMARY

PUBCHEM

154731615

Created by admin on Sat Dec 16 18:02:20 UTC 2023 , Edited by admin on Sat Dec 16 18:02:20 UTC 2023

PRIMARY

CAS

63348-34-5

Created by admin on Sat Dec 16 18:02:20 UTC 2023 , Edited by admin on Sat Dec 16 18:02:20 UTC 2023

PRIMARY

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TRICLOCARBAN

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