Compound Identification
SMILES
C[C@@]12CC[C@@H]3[C@H](CC3(C)C)C(CCC1O2)=CC1=CC=CC=C1CN1O[C@@H]2[C@H]3OC(O[C@H]3[C@@H]3C[C@@]2([C@@H]1C(=O)O3)C(=O)NCCC(=O)NCCO)(C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=DUQLRDWNAWCBFC-SJUNMFRRSA-N
Formula
C49H57N3O9
Mass
832.007
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- 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
Not available
Direct Parent
Terpene lactones
Alternative Parents
Sesquiterpenoids Alpha amino acid esters Diphenylmethanes Beta amino acids and derivatives N-acylethanolamines Delta valerolactones Ketals Oxanes 1,3-dioxolanes Isoxazolidines Secondary carboxylic acid amides Carboxylic acid esters Epoxides Dialkyl ethers Oxacyclic compounds Azacyclic compounds N-organohydroxylamines Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organopnictogen compounds Primary alcohols Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Terpene lactone - Caryophyllane sesquiterpenoid - Sesquiterpenoid - Alpha-amino acid ester - Diphenylmethane - Beta amino acid or derivatives - Alpha-amino acid or derivatives - N-acylethanolamine - Ketal - Delta valerolactone - Delta_valerolactone - Monocyclic benzene moiety - Benzenoid - Oxane - Meta-dioxolane - Isoxazolidine - Carboxamide group - Carboxylic acid ester - Lactone - Secondary carboxylic acid amide - Alkanolamine - Carboxylic acid derivative - Acetal - Oxacycle - Dialkyl ether - Azacycle - Oxirane - Ether - N-organohydroxylamine - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organooxygen compound - Organonitrogen compound - Primary alcohol - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Alcohol - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as terpene lactones. These are prenol lipids containing a lactone ring.
External Descriptors
Not available