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

Details

Stereochemistry ACHIRAL
Molecular Formula C14H24N4O5
Molecular Weight 328.3642
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (1,4,7,10-TETRAAZA-11-OXO-BICYCLO(8.2.2)TETRADECANE-4,7-DIACETIC ACID)

SMILES

OC(=O)CN1CCN2CCN(CCN(CC(O)=O)CC1)C(=O)C2

InChI

InChIKey=DBYNHTDVIPODPK-UHFFFAOYSA-N
InChI=1S/C14H24N4O5/c19-12-9-15-1-2-16(10-13(20)21)3-4-17(11-14(22)23)6-8-18(12)7-5-15/h1-11H2,(H,20,21)(H,22,23)

HIDE SMILES / InChI

Molecular Formula C14H24N4O5
Molecular Weight 328.3642
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:38:02 GMT 2023
Edited
by admin
on Sat Dec 16 18:38:02 GMT 2023
Record UNII
O4V6XA23KP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(1,4,7,10-TETRAAZA-11-OXO-BICYCLO(8.2.2)TETRADECANE-4,7-DIACETIC ACID)
Systematic Name English
1,4,7,10-TETRAAZABICYCLO(8.2.2)TETRADECANE-4,7-DIACETIC ACID, 11-OXO-
Systematic Name English
GADOTERIDOL RELATED COMPOUND C [USP-RS]
Common Name English
Code System Code Type Description
CAS
220182-19-4
Created by admin on Sat Dec 16 18:38:03 GMT 2023 , Edited by admin on Sat Dec 16 18:38:03 GMT 2023
PRIMARY
RS_ITEM_NUM
1287664
Created by admin on Sat Dec 16 18:38:03 GMT 2023 , Edited by admin on Sat Dec 16 18:38:03 GMT 2023
PRIMARY
FDA UNII
O4V6XA23KP
Created by admin on Sat Dec 16 18:38:03 GMT 2023 , Edited by admin on Sat Dec 16 18:38:03 GMT 2023
PRIMARY
PUBCHEM
125310511
Created by admin on Sat Dec 16 18:38:03 GMT 2023 , Edited by admin on Sat Dec 16 18:38:03 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY