Compound Identification
SMILES
CC1CCCC2(C)CC3OC(=O)C(CN4CCN(CC4)C(C4=CC=C(F)C=C4)C4=CC=C(F)C=C4)C3C3OC123
InChIKey
InChIKey=RVDHJNLNSAIWPS-UHFFFAOYSA-N
Formula
C32H38F2N2O3
Mass
536.664
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
- Subclass Terpene lactones
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Class
Prenol lipids
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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
Eudesmanolides, secoeudesmanolides, and derivatives
Alternative Parents
Sesquiterpenoids Naphthofurans Diphenylmethanes Oxepanes Aralkylamines N-alkylpiperazines Fluorobenzenes Aryl fluorides Gamma butyrolactones Oxolanes Trialkylamines Carboxylic acid esters Amino acids and derivatives Epoxides Monocarboxylic acids and derivatives Dialkyl ethers Oxacyclic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Eudesmanolide - Sesquiterpenoid - Diphenylmethane - Naphthofuran - Fluorobenzene - Halobenzene - Oxepane - Aralkylamine - N-alkylpiperazine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Gamma butyrolactone - Piperazine - Benzenoid - Oxolane - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Lactone - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Dialkyl ether - Oxirane - Ether - Oxacycle - Monocarboxylic acid or derivatives - Amine - Carbonyl group - Organohalogen compound - Organic nitrogen compound - Organofluoride - Organic oxygen compound - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as eudesmanolides, secoeudesmanolides, and derivatives. These are terpenoids with a structure based on the eudesmanolide (a 3,5a,9-trimethyl-naphtho[1,2-b]furan-2-one derivative) or secoeudesmanolide (a 3,6-dimethyl-5-(pentan-2-yl)-1-benzofuran-2-one derivative) skeleton.
External Descriptors
Not available