Compound Identification
SMILES
CC(=O)OCC12[C@H](CC[C@](C)(O)C11OC(C)(C)C(C1OC(C)=O)[C@@H](OC(=O)C1=CN=CC=C1)[C@H]2OC(=O)C1=CC=CC=C1)OC(=O)\C=C/C1=CC=CC=C1
InChIKey
InChIKey=HDEHKRKYWFVKMW-UGNWAXRJSA-N
Formula
C41H43NO12
Mass
741.79
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
Agarofurans Cinnamic acid esters Benzoic acid esters Pyridinecarboxylic acids Styrenes Benzoyl derivatives Oxepanes Fatty acid esters Tetrahydrofurans Tertiary alcohols Heteroaromatic compounds Enoate esters Cyclic alcohols and derivatives Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pentacarboxylic acid or derivatives - Sesquiterpenoid - Agarofuran - Cinnamic acid ester - Cinnamic acid or derivatives - Benzoate ester - Pyridine carboxylic acid or derivatives - Pyridine carboxylic acid - Benzoic acid or derivatives - Styrene - Benzoyl - Oxepane - Fatty acid ester - Fatty acyl - Benzenoid - Pyridine - Monocyclic benzene moiety - Heteroaromatic compound - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tetrahydrofuran - Tertiary alcohol - Cyclic alcohol - Carboxylic acid ester - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Dialkyl ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Alcohol - 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