Compound Identification
SMILES
[I-].CCC[N+](C)(C)CC1C2CC[C@H](C)C3CC[C@@]4(C)O[C@H]4[C@]23OC1=O
InChIKey
InChIKey=MWMWPSGMBPNMPM-HOUAPUPFSA-M
Formula
C20H34INO3
Mass
463.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
Subclass
Terpene lactones
-
Level 5
Sesquiterpene lactones
- Level 6 Cadinanolides
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Level 5
Sesquiterpene lactones
-
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
Sesquiterpene lactones
Direct Parent
Cadinanolides
Alternative Parents
Sesquiterpenoids Oxepanes Gamma butyrolactones Tetraalkylammonium salts Oxolanes Carboxylic acid esters Oxacyclic compounds Dialkyl ethers Epoxides Monocarboxylic acids and derivatives Organic oxides Amines Hydrocarbon derivatives Carbonyl compounds Organic iodide salts Organic cations
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Cadinanolide skeleton - Sesquiterpenoid - Oxepane - Gamma butyrolactone - Tetraalkylammonium salt - Oxolane - Quaternary ammonium salt - Carboxylic acid ester - Lactone - Carboxylic acid derivative - Dialkyl ether - Oxirane - Ether - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic iodide salt - Amine - Organic salt - Organic cation - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cadinanolides. These are sesquiterpene lactones based on 2-dioxonaphtho[4a,4-b]furan.
External Descriptors
Not available