Compound Identification
SMILES
OC(=O)[C@H](CC1=CNC2=CC=CC=C12)NC1=NC(N[C@H](CC2=CNC3=CC=CC=C23)C(O)=O)=NC(NCCN(CCNC2=NC(N[C@@H](CC3=CNC4=CC=CC=C34)C(O)=O)=NC(N[C@H](CC3=CNC4=CC=CC=C34)C(O)=O)=N2)CCNC2=NC(N[C@@H](CC3=CNC4=CC=CC=C34)C(O)=O)=NC(N[C@H](CC3=CNC4=CC=CC=C34)C(O)=O)=N2)=N1
InChIKey
InChIKey=CQQZKGFGUHWCDG-CGONPYARSA-N
Formula
C81H81N25O12
Mass
1596.702
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
Indolyl carboxylic acids and derivatives 3-alkylindoles D-alpha-amino acids L-alpha-amino acids Secondary alkylarylamines N-aliphatic s-triazines 1,3,5-triazines Benzenoids Substituted pyrroles Heteroaromatic compounds Amino acids Trialkylamines Carboxylic acids Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hexacarboxylic acid or derivatives - Indolyl carboxylic acid derivative - Alpha-amino acid or derivatives - L-alpha-amino acid - D-alpha-amino acid - 3-alkylindole - Indole - Indole or derivatives - Amino-1,3,5-triazine - Aminotriazine - Secondary aliphatic/aromatic amine - N-aliphatic s-triazine - 1,3,5-triazine - Substituted pyrrole - Triazine - Benzenoid - Pyrrole - Heteroaromatic compound - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Amino acid - Organoheterocyclic compound - Secondary amine - Carboxylic acid - Azacycle - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organic oxide - Organooxygen compound - Organic nitrogen compound - Amine - 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