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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Terpene lactones
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Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
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
Aromatic monoterpenoids Monocyclic monoterpenoids Ketals Benzene and substituted derivatives Vinylogous esters Vinylogous acids Enoate esters Amino acids and derivatives Ketene acetals Lactones Oxacyclic compounds Enamines Nitriles Monocarboxylic acids and derivatives Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Monoalkylamines
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