Compound Identification
SMILES
[Gd+3].CC(N1CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1)C(=O)NCC(=O)NNC(=O)COC1=C(C2=CC=CC=C2C=C1)C1=C(OCC(=O)NNC(=O)CNC(=O)C(C)N2CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC2)C=CC2=CC=CC=C12
InChIKey
InChIKey=TWNHDXLKEPRKAK-UHFFFAOYSA-N
Formula
C62H84GdN14O20
Mass
1502.68
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Hexacarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Hexacarboxylic acids and derivatives
Alternative Parents
Dipeptides N-acyl-alpha amino acids and derivatives Alpha amino acid amides Alanine and derivatives Alpha amino acids Naphthalenes Phenol ethers Alkyl aryl ethers Diacylhydrazines Trialkylamines Secondary carboxylic acid amides Amino acids Azacyclic compounds Carboxylic acids Organic oxides Carbonyl compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Hexacarboxylic acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alanine or derivatives - Naphthalene - Alpha-amino acid or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid - Phenol ether - Alkyl aryl ether - Benzenoid - Diacylhydrazine - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid hydrazide - Amino acid - Organoheterocyclic compound - Carboxylic acid - Azacycle - Ether - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as hexacarboxylic acids and derivatives. These are carboxylic acids containing exactly six carboxyl groups.
External Descriptors
Not available