CAS 60239-18-1 1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic Acid

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Macrocycles

1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic Acid

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Catalog Number

ACM60239181

Product Name

1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic Acid

Structure

CAS

60239-18-1

Category

Macrocycles

Synonyms

J-650232; AJ-80871; MFCD00068657; CHEBI:61028; LS-187777; CS-0046228; 2,2',2'',2'''-(1,4,7,10-tetraazacyclododecane-1,4,7,10-tetrayl)tetraacetic acid; ZINC22059268; BCP13075; 1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic Acid Europium;

IUPAC Name

2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;

Molecular Weight

404.42g/mol

Molecular Formula

C16H28N4O8;

Canonical SMILES

C1CN(CCN(CCN(CCN1CC(=O)O)CC(=O)O)CC(=O)O)CC(=O)O;

InChI

InChI=1S/C16H28N4O8/c21-13(22)9-17-1-2-18(10-14(23)24)5-6-20(12-16(27)28)8-7-19(4-3-17)11-15(25)26/h1-12H2,(H,21,22)(H,23,24)(H,25,26)(H,27,28);

InChI Key

WDLRUFUQRNWCPK-UHFFFAOYSA-N;

Application

Bifunctional DOTA aconjugates to peptides and has become an established strategy for constructing target-specific metal containing agents including targeted MRI contrast agents and diagnostic and ther

apeutic radiopharmaceuticals.

Complexity

447

Covalently-Bonded Unit Count

EC Number

611-959-5

Exact Mass

404.191g/mol

Heavy Atom Count

Monoisotopic Mass

404.191g/mol

NSC Number

681107