Structure Information
Structure

Compound Identification

SMILES

CC1(C)OC(O)=C(C(C(C#N)C(N)=C(C#N)C#N)C2=CC=CC=C2)C(=O)O1

InChIKey

InChIKey=UMDIIWRWZIYKRQ-UHFFFAOYSA-N

Formula

C19H16N4O4

Mass

364.361

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Terpene lactones

Intermediate Tree Nodes

Not available

Direct Parent

Terpene lactones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Terpene lactone - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - Ketal - Monocyclic benzene moiety - Benzenoid - Vinylogous ester - Vinylogous acid - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Amino acid or derivatives - Carboxylic acid ester - Ketene acetal or derivatives - Lactone - Acetal - Carboxylic acid derivative - Enamine - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Carbonitrile - Nitrile - Primary aliphatic amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Cyanide - Organic oxygen compound - Organopnictogen compound - Carbonyl group - Amine - Organonitrogen compound - Organooxygen compound - Primary amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as terpene lactones. These are prenol lipids containing a lactone ring.

External Descriptors

Not available

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