U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C14H23N4O6.3Na
Molecular Weight 412.3249
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Trisodium 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate

SMILES

[Na+].[Na+].[Na+].[O-]C(=O)CN1CCNCCN(CC([O-])=O)CCN(CC([O-])=O)CC1

InChI

InChIKey=OKHVSTSMWHWVMK-UHFFFAOYSA-K
InChI=1S/C14H26N4O6.3Na/c19-12(20)9-16-3-1-15-2-4-17(10-13(21)22)6-8-18(7-5-16)11-14(23)24;;;/h15H,1-11H2,(H,19,20)(H,21,22)(H,23,24);;;/q;3*+1/p-3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
1,4,7,10-Tetraazacyclododecane-1,4,7-triacetic acid, sodium salt (1:3)
Preferred Name English
Trisodium 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate
Systematic Name English
1,4,7,10-Tetraazacyclododecane-1,4,7-triacetic acid, trisodium salt
Systematic Name English
Code System Code Type Description
CAS
217973-03-0
Created by admin on Wed Apr 02 17:05:35 GMT 2025 , Edited by admin on Wed Apr 02 17:05:35 GMT 2025
PRIMARY
FDA UNII
7B6Z3HP8UY
Created by admin on Wed Apr 02 17:05:35 GMT 2025 , Edited by admin on Wed Apr 02 17:05:35 GMT 2025
PRIMARY
PUBCHEM
10862527
Created by admin on Wed Apr 02 17:05:35 GMT 2025 , Edited by admin on Wed Apr 02 17:05:35 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966