Compound Identification
SMILES
C[C@H]1CC[C@H]2C(CN3CCC(O)(CC3)C3=CC=CC=C3)C(=O)O[C@H]2[C@@]2(C)[C@H]1C(CC2=O)N1CCC(O)(CC1)C1=CC=CC=C1
InChIKey
InChIKey=PFCSZKBLPXYUPY-YLLKCVSYSA-N
Formula
C37H48N2O5
Mass
600.8
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
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Subclass
Terpene lactones
- Level 5 Sesquiterpene lactones
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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
Sesquiterpene lactones
Direct Parent
Ambrosanolides and secoambrosanolides
Alternative Parents
Pseudoguaianes Phenylpiperidines Aralkylamines Benzene and substituted derivatives Gamma butyrolactones Tertiary alcohols Oxolanes Amino acids and derivatives Trialkylamines Carboxylic acid esters Ketones Azacyclic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Ambrosanolide - Pseudoguaiane sesquiterpenoid - Sesquiterpenoid - Phenylpiperidine - Aralkylamine - Monocyclic benzene moiety - Gamma butyrolactone - Piperidine - Benzenoid - Oxolane - Tertiary alcohol - Amino acid or derivatives - Carboxylic acid ester - Ketone - Lactone - Tertiary aliphatic amine - Tertiary amine - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Alcohol - Amine - Organic oxide - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Aromatic 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