Compound Identification
SMILES
OC(=O)CN(CC(O)=O)C(CN(CC(O)=O)C1CCCCC1N(CC(O)=O)CC(O)=O)CC1=CC=C(NC(=S)NC2=CC(C(O)=O)=C(C=C2)C2=C3C=CC(=O)C=C3OC3C=C(O)C=CC23)C=C1
InChIKey
InChIKey=CMALOOJPJBLZEE-UHFFFAOYSA-N
Formula
C46H49N5O15S
Mass
943.98
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
Pentacarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pentacarboxylic acids and derivatives
Alternative Parents
Alpha amino acids N-phenylthioureas Amphetamines and derivatives Benzoic acids Benzoyl derivatives Aralkylamines Cyclohexylamines Pyrans Vinylogous esters Trialkylamines Thioureas Amino acids Cyclic ketones Oxacyclic compounds Enols Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pentacarboxylic acid or derivatives - Alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - N-phenylthiourea - Benzoic acid or derivatives - Benzoic acid - Benzoyl - Aralkylamine - Cyclohexylamine - Monocyclic benzene moiety - Benzenoid - Pyran - Vinylogous ester - Tertiary amine - Cyclic ketone - Tertiary aliphatic amine - Thiourea - Amino acid or derivatives - Amino acid - Ketone - Enol - Organoheterocyclic compound - Carboxylic acid - Oxacycle - Amine - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pentacarboxylic acids and derivatives. These are carboxylic acids containing exactly five carboxyl groups.
External Descriptors
Not available