METOCLOPRAMIDE N4-O-GLUCURONIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H30ClN3O9
Molecular Weight	491.92
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of METOCLOPRAMIDE N4-O-GLUCURONIDE

Structure Search

SMILES

CCN(CC)CCNC(=O)C1=C(OC)C=C(NO[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)C(Cl)=C1

InChI

InChIKey=QMQBXUZTKAFXKY-GHHWKCCRSA-N

InChI=1S/C20H30ClN3O9/c1-4-24(5-2)7-6-22-18(28)10-8-11(21)12(9-13(10)31-3)23-33-20-16(27)14(25)15(26)17(32-20)19(29)30/h8-9,14-17,20,23,25-27H,4-7H2,1-3H3,(H,22,28)(H,29,30)/t14-,15-,16+,17-,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H30ClN3O9
Molecular Weight	491.92
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 16:10:44 UTC 2023` Edited by `admin` on `Sat Dec 16 16:10:44 UTC 2023`
Record UNII	ZAZ9ZKZ9BJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

METOCLOPRAMIDE N4-O-GLUCURONIDE

Common Name

English

.BETA.-D-GLUCOPYRANURONIC ACID, 1-O-((2-CHLORO-4-(((2-(DIETHYLAMINO)ETHYL)AMINO)CARBONYL)-5-METHOXYPHENYL)AMINO)-

Systematic Name

English

GLUCOPYRANURONIC ACID, 1-((6-CHLORO-4-((2-(DIETHYLAMINO)ETHYL)CARBAMOYL)-M-ANISIDINO)OXY)-1-DEOXY-, .BETA.-D-

Common Name

English

1-O-((2-CHLORO-4-(((2-(DIETHYLAMINO)ETHYL)AMINO)CARBONYL)-5-METHOXYPHENYL)AMINO)-.BETA.-D-GLUCOPYRANURONIC ACID

Systematic Name

English

METOCLOPRAMIDE METABOLITE M1

Common Name

English

Code System Code Type Description

FDA UNII

ZAZ9ZKZ9BJ

Created by admin on Sat Dec 16 16:10:44 UTC 2023 , Edited by admin on Sat Dec 16 16:10:44 UTC 2023

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CAS

27298-15-3

Created by admin on Sat Dec 16 16:10:44 UTC 2023 , Edited by admin on Sat Dec 16 16:10:44 UTC 2023

PRIMARY

PUBCHEM

154572860

Created by admin on Sat Dec 16 16:10:44 UTC 2023 , Edited by admin on Sat Dec 16 16:10:44 UTC 2023

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METOCLOPRAMIDE

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Comments:

IN VITRO AND IN VIVO

Amount: