Compound Identification
SMILES
C[C@@H]1CCC=C2C[C@H]3OC(=O)[C@H](C[NH+]4CCC(CC5=CC=CC=C5)CC4)[C@H]3[C@H](O)[C@]12C
InChIKey
InChIKey=LFQOBUGWTJTTGE-DBFQGJLESA-O
Formula
C27H38NO3
Mass
424.604
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
Eremophilanolides and secoeremophilanolides Sesquiterpenoids 4-benzylpiperidines Naphthofurans Aralkylamines Gamma butyrolactones Benzene and substituted derivatives Tetrahydrofurans Trialkylamines Secondary alcohols Amino acids and derivatives Cyclic alcohols and derivatives Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Terpene lactone - Eremophilanolide or secoeremophilanolide - Sesquiterpenoid - Naphthofuran - 4-benzylpiperidine - Benzylpiperidine - Aralkylamine - Monocyclic benzene moiety - Gamma butyrolactone - Piperidine - Benzenoid - Cyclic alcohol - Tetrahydrofuran - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Lactone - Amino acid or derivatives - Secondary alcohol - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organopnictogen compound - Alcohol - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Amine - Organic cation - Aromatic heteropolycyclic 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