Compound Identification
SMILES
C[C@H]1CCC2C(CN3CCCCC3)C(=O)OC2[C@]2(C)C(=O)CC(N3CCCCC3)[C@]12O
InChIKey
InChIKey=OHHTTZSMJOEEAZ-LEGHWCNISA-N
Formula
C25H40N2O4
Mass
432.605
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
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Subclass
Terpene lactones
- Level 5 Sesquiterpene lactones
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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
Ambrosanolides and secoambrosanolides
Alternative Parents
Pseudoguaianes Gamma butyrolactones Piperidines Tetrahydrofurans Tertiary alcohols 1,2-aminoalcohols Amino acids and derivatives Carboxylic acid esters Cyclic alcohols and derivatives Trialkylamines Ketones Azacyclic compounds Monocarboxylic acids and derivatives Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Ambrosanolide - Sesquiterpenoid - Pseudoguaiane sesquiterpenoid - Gamma butyrolactone - Piperidine - Cyclic alcohol - Tetrahydrofuran - Tertiary alcohol - 1,2-aminoalcohol - Amino acid or derivatives - Carboxylic acid ester - Ketone - Lactone - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Alcohol - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as ambrosanolides and secoambrosanolides. These are sesquiterpene lactones from the Ambrosia family, with a backbone derivative of azuleno[6,5-b]furan-2-one (ambrosanolides) or azuleno[4,5-b]furan-2-one (secoambrosanolides).
External Descriptors
Not available