N1-(2,3-Dihydroxypropyl)-N3-[2-hydroxy-1-(hydroxymethyl)ethyl]-5-[[(2S)-2-hydroxy-1-oxopropyl]amino]-2,4,6-triiodo-1,3-benzenedicarboxamide

Details

Stereochemistry	EPIMERIC
Molecular Formula	C17H22I3N3O8
Molecular Weight	777.0853
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N<SUP>1</SUP>-(2,3-Dihydroxypropyl)-N<SUP>3</SUP>-[2-hydroxy-1-(hydroxymethyl)ethyl]-5-[[(2S)-2-hydroxy-1-oxopropyl]amino]-2,4,6-triiodo-1,3-benzenedicarboxamide

Structure Search

SMILES

C[C@H](O)C(=O)NC1=C(I)C(C(=O)NCC(O)CO)=C(I)C(C(=O)NC(CO)CO)=C1I

InChI

InChIKey=QHJLLNBHYBVXAU-UUEFVBAFSA-N

InChI=1S/C17H22I3N3O8/c1-6(27)15(29)23-14-12(19)9(16(30)21-2-8(28)5-26)11(18)10(13(14)20)17(31)22-7(3-24)4-25/h6-8,24-28H,2-5H2,1H3,(H,21,30)(H,22,31)(H,23,29)/t6-,8?/m0/s1

HIDE SMILES / InChI

Molecular Formula	C17H22I3N3O8
Molecular Weight	777.0853
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	1 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 19:16:39 GMT 2025` Edited by `admin` on `Wed Apr 02 19:16:39 GMT 2025`
Record UNII	GD5LJ93QY2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N1-(2,3-Dihydroxypropyl)-N3-[2-hydroxy-1-(hydroxymethyl)ethyl]-5-[[(2S)-2-hydroxy-1-oxopropyl]amino]-2,4,6-triiodo-1,3-benzenedicarboxamide

Systematic Name

English

Iopamidol EP Impurity G

Preferred Name

English

1,3-Benzenedicarboxamide, N1-(2,3-dihydroxypropyl)-N3-[2-hydroxy-1-(hydroxymethyl)ethyl]-5-[[(2S)-2-hydroxy-1-oxopropyl]amino]-2,4,6-triiodo-

Systematic Name

English

Code System Code Type Description

FDA UNII

GD5LJ93QY2

Created by admin on Wed Apr 02 19:16:39 GMT 2025 , Edited by admin on Wed Apr 02 19:16:39 GMT 2025

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CAS

1869069-72-6

Created by admin on Wed Apr 02 19:16:39 GMT 2025 , Edited by admin on Wed Apr 02 19:16:39 GMT 2025

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PUBCHEM

168444018

Created by admin on Wed Apr 02 19:16:39 GMT 2025 , Edited by admin on Wed Apr 02 19:16:39 GMT 2025

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