Des-(2-methoxyethyl)amino gadoverstamide

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H26N4O10.Gd.H
Molecular Weight	604.67
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Des-(2-methoxyethyl)amino gadoverstamide

Structure Search

SMILES

[H+].[Gd+3].COCCNC(=O)CN(CCN(CCN(CC([O-])=O)CC([O-])=O)CC([O-])=O)CC([O-])=O

InChI

InChIKey=WNSXLJYCMHYWKN-UHFFFAOYSA-K

InChI=1S/C17H30N4O10.Gd/c1-31-7-2-18-13(22)8-20(10-15(25)26)5-3-19(9-14(23)24)4-6-21(11-16(27)28)12-17(29)30;/h2-12H2,1H3,(H,18,22)(H,23,24)(H,25,26)(H,27,28)(H,29,30);/q;+3/p-3

HIDE SMILES / InChI

Molecular Formula	C17H26N4O10
Molecular Weight	446.4091
Charge	-4
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	H
Molecular Weight	1.0079
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	Gd
Molecular Weight	157.25
Charge	3
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:31:07 UTC 2023` Edited by `admin` on `Sat Dec 16 10:31:07 UTC 2023`
Record UNII	XGN4B64R4K
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Des-(2-methoxyethyl)amino gadoverstamide

Systematic Name

English

HYDROGEN (8,11,14-TRIS(CARBOXYMETHYL)-6-OXO-2-OXA-5,8,11,14-TETRAAZAHEXADECAN-16-OATO(4-))GADOLINIUM

Systematic Name

English

Gadolinate(1-), [8,11,14-tris[(carboxy-κO)methyl]-6-(oxo-κO)-2-oxa-5,8,11,14-tetraazahexadecan-16-oato(4-)-κN8,κN11,κN14,κO16]-, hydrogen

Systematic Name

English

Gadoversetamide Related Compound A [USP IMPURITY]

Common Name

English

Code System Code Type Description

PUBCHEM

131667540

Created by admin on Sat Dec 16 10:31:08 UTC 2023 , Edited by admin on Sat Dec 16 10:31:08 UTC 2023

PRIMARY

CAS

459799-37-2

Created by admin on Sat Dec 16 10:31:08 UTC 2023 , Edited by admin on Sat Dec 16 10:31:08 UTC 2023

PRIMARY

FDA UNII

XGN4B64R4K

Created by admin on Sat Dec 16 10:31:08 UTC 2023 , Edited by admin on Sat Dec 16 10:31:08 UTC 2023

PRIMARY

Related Record Type Details


					RLM74T3Z9D

GADOVERSETAMIDE

PARENT -> IMPURITY

Amount: