Compound Identification
SMILES
C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@@H](C[NH+]4CCN(CC4)C4=CC=CC(C)=C4)[C@H]3[C@H]3O[C@@]123
InChIKey
InChIKey=JMGOFRBCTALPQQ-QXYMXEMSSA-O
Formula
C26H37N2O3
Mass
425.592
Taxonomic Classification
Taxonomy Tree
-
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 Phenylpiperazines N-arylpiperazines Aminotoluenes Aniline and substituted anilines Dialkylarylamines N-alkylpiperazines Oxepanes Gamma butyrolactones Oxolanes Quaternary ammonium salts Trialkylamines Amino acids and derivatives Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Epoxides Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Eudesmanolide - Sesquiterpenoid - Naphthofuran - Phenylpiperazine - N-arylpiperazine - Tertiary aliphatic/aromatic amine - Aminotoluene - Aniline or substituted anilines - Dialkylarylamine - Oxepane - Toluene - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Gamma butyrolactone - Piperazine - Benzenoid - Quaternary ammonium salt - Oxolane - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Lactone - Amino acid or derivatives - Azacycle - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Monocarboxylic acid or derivatives - Oxirane - Ether - Carbonyl group - Amine - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic cation - 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