Compound Identification
SMILES
CCOC(=O)C1=C(N(C2OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C(=S)C(C#N)=C1C1=CC=C(OC)C=C1)C1=CC=CC=C1
InChIKey
InChIKey=JFVOFTLGWNTAFL-UHFFFAOYSA-N
Formula
C36H36N2O12S
Mass
720.75
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
Phenylpyridines Hexoses Glycosylamines Pyridinecarboxylic acids Dihydropyridinecarboxylic acids and derivatives Phenoxy compounds 3-pyridinecarbonitriles Anisoles Methoxybenzenes Alkyl aryl ethers Oxanes Vinylogous amides Thiolactams Heteroaromatic compounds Carboxylic acid esters Nitriles Oxacyclic compounds Azacyclic compounds Organic oxides Carbonyl compounds Organopnictogen compounds Organosulfur compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pentacarboxylic acid or derivatives - Hexose monosaccharide - 2-phenylpyridine - 4-phenylpyridine - Glycosyl compound - N-glycosyl compound - Dihydropyridinecarboxylic acid derivative - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Anisole - Phenoxy compound - Phenol ether - 3-pyridinecarbonitrile - Methoxybenzene - Dihydropyridine - Alkyl aryl ether - Pyridine - Monocyclic benzene moiety - Benzenoid - Oxane - Hydropyridine - Monosaccharide - Thiolactam - Vinylogous amide - Heteroaromatic compound - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Oxacycle - Ether - Carbonitrile - Nitrile - Organosulfur compound - Carbonyl group - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic 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