Compound Identification
SMILES
CC(C)C1=CC(=C(C=C1)C1CCCC1)C1=C(O)C(=S)C(=O)OC1C1=CC=C(OCC2=CN=CC=C2)C=C1
InChIKey
InChIKey=BRJXGBFHSWOVFQ-UHFFFAOYSA-N
Formula
C31H31NO4S
Mass
513.65
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Terpene lactones
-
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
Stilbenes Aromatic monoterpenoids Monocyclic monoterpenoids Phenylpropanes Cumenes Phenoxy compounds Phenol ethers Alkyl aryl ethers Dihydropyranones Pyridines and derivatives Heteroaromatic compounds Thioketones Carboxylic acid esters Lactones Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Enols Organonitrogen compounds Organic oxides Organopnictogen compounds Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Terpene lactone - Stilbene - P-cymene - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - Cumene - Phenylpropane - Phenoxy compound - Phenol ether - Alkyl aryl ether - Dihydropyranone - Benzenoid - Monocyclic benzene moiety - Pyridine - Pyran - Heteroaromatic compound - Thioketone - Carboxylic acid ester - Lactone - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Oxacycle - Enol - Ether - Monocarboxylic acid or derivatives - Thiocarbonyl group - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organosulfur compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - 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