3,3'-DIIODOTHYRONINE, L-

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H13I2NO4
Molecular Weight	525.077
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,3'-DIIODOTHYRONINE, L-

Structure Search

SMILES

N[C@@H](CC1=CC=C(OC2=CC=C(O)C(I)=C2)C(I)=C1)C(O)=O

InChI

InChIKey=CPCJBZABTUOGNM-LBPRGKRZSA-N

InChI=1S/C15H13I2NO4/c16-10-7-9(2-3-13(10)19)22-14-4-1-8(5-11(14)17)6-12(18)15(20)21/h1-5,7,12,19H,6,18H2,(H,20,21)/t12-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C15H13I2NO4
Molecular Weight	525.077
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:58:19 GMT 2025` Edited by `admin` on `Mon Mar 31 19:58:19 GMT 2025`
Record UNII	3L9U2Z4602
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

L-3,3'-DIIODOTHYRONINE

Preferred Name

English

3,3'-DIIODOTHYRONINE, L-

Common Name

English

3,3'-DIIODO-L-THYRONINE

Systematic Name

English

O-(4-HYDROXY-3-IODOPHENYL)-3-IODO-L-TYROSINE

Systematic Name

English

LEVOTHYROXINE SODIUM IMPURITY J [EP IMPURITY]

Common Name

English

L-TYROSINE, O-(4-HYDROXY-3-IODOPHENYL)-3-IODO-

Systematic Name

English

3,3'-DIIODOTHYRONINE

Common Name

English

ALANINE, 3-(4-(4-HYDROXY-3-IODOPHENOXY)-3-IODOPHENYL)-, L-

Systematic Name

English

(2S)-2-AMINO-3-(4-(4-HYDROXY-3-IODOPHENOXY)-3-IODOPHENYL)PROPANOIC ACID

Systematic Name

English

Classification Tree Code System Code

DSLD

3360 (Number of products:19)

Created by admin on Mon Mar 31 19:58:19 GMT 2025 , Edited by admin on Mon Mar 31 19:58:19 GMT 2025

Code System Code Type Description

PUBCHEM

107564

Created by admin on Mon Mar 31 19:58:19 GMT 2025 , Edited by admin on Mon Mar 31 19:58:19 GMT 2025

PRIMARY

FDA UNII

3L9U2Z4602

Created by admin on Mon Mar 31 19:58:19 GMT 2025 , Edited by admin on Mon Mar 31 19:58:19 GMT 2025

PRIMARY

CHEBI

35430

Created by admin on Mon Mar 31 19:58:19 GMT 2025 , Edited by admin on Mon Mar 31 19:58:19 GMT 2025

PRIMARY

ECHA (EC/EINECS)

225-005-7

Created by admin on Mon Mar 31 19:58:19 GMT 2025 , Edited by admin on Mon Mar 31 19:58:19 GMT 2025

PRIMARY

CHEBI

45698

Created by admin on Mon Mar 31 19:58:19 GMT 2025 , Edited by admin on Mon Mar 31 19:58:19 GMT 2025

PRIMARY

CAS

4604-41-5

Created by admin on Mon Mar 31 19:58:19 GMT 2025 , Edited by admin on Mon Mar 31 19:58:19 GMT 2025

PRIMARY

EPA CompTox

DTXSID80196697

Created by admin on Mon Mar 31 19:58:19 GMT 2025 , Edited by admin on Mon Mar 31 19:58:19 GMT 2025

PRIMARY

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3,3'-DIIODOTHYRONINE, DL-

RACEMATE -> ENANTIOMER

Amount:

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PARENT -> METABOLITE INACTIVE

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					9J765S329G

LEVOTHYROXINE SODIUM

PARENT -> IMPURITY

Comments:

UNSPECIFIED

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: