5-(ACETYL(2,3-DIHYDROXYPROPYL)AMINO)-N-(3-(2,3-DIHYDROXYPROPOXY)-2-HYDROXYPROPYL)-N'-(2,3-DIHYDROXYPROPYL)-2,4,6-TRIIODOBENZENE-1,3-DICARBOXAMIDE

Details

Stereochemistry	MIXED
Molecular Formula	C22H32I3N3O11
Molecular Weight	895.2164
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-(ACETYL(2,3-DIHYDROXYPROPYL)AMINO)-N-(3-(2,3-DIHYDROXYPROPOXY)-2-HYDROXYPROPYL)-N'-(2,3-DIHYDROXYPROPYL)-2,4,6-TRIIODOBENZENE-1,3-DICARBOXAMIDE

Structure Search

SMILES

CC(=O)N(CC(O)CO)C1=C(I)C(C(=O)NCC(O)CO)=C(I)C(C(=O)NCC(O)COCC(O)CO)=C1I

InChI

InChIKey=AJMHZDREGNQKOE-UHFFFAOYSA-N

InChI=1S/C22H32I3N3O11/c1-10(32)28(4-13(35)6-30)20-18(24)15(21(37)26-2-11(33)5-29)17(23)16(19(20)25)22(38)27-3-12(34)8-39-9-14(36)7-31/h11-14,29-31,33-36H,2-9H2,1H3,(H,26,37)(H,27,38)

HIDE SMILES / InChI

Molecular Formula	C22H32I3N3O11
Molecular Weight	895.2164
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:16:47 GMT 2023` Edited by `admin` on `Sat Dec 16 09:16:47 GMT 2023`
Record UNII	124TZ8296O
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-(ACETYL(2,3-DIHYDROXYPROPYL)AMINO)-N-(3-(2,3-DIHYDROXYPROPOXY)-2-HYDROXYPROPYL)-N'-(2,3-DIHYDROXYPROPYL)-2,4,6-TRIIODOBENZENE-1,3-DICARBOXAMIDE

Systematic Name

English

(±)-5-(ACETYL(2,3-DIHYDROXYPROPYL)AMINO)-N-(3-(2,3-DIHYDROXYPROPOXY)-2-HYDROXYPROPYL)-N'-(2,3-DIHYDROXYPROPYL)-2,4,6-TRIIODOBENZENE-1,3-DICARBOXAMIDE

Systematic Name

English

IOHEXOL IMPURITY D [EP IMPURITY]

Common Name

English

Code System Code Type Description

PUBCHEM

139032790

Created by admin on Sat Dec 16 09:16:47 GMT 2023 , Edited by admin on Sat Dec 16 09:16:47 GMT 2023

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FDA UNII

124TZ8296O

Created by admin on Sat Dec 16 09:16:47 GMT 2023 , Edited by admin on Sat Dec 16 09:16:47 GMT 2023

PRIMARY