Compound Identification
SMILES
C[C@@]12CC[C@@H]3[C@H](CC3(C)C)C(CCC1O2)=CC1=CC=CC=C1C(=O)O[C@@H]1CC(=C[C@H]2OC3(CC4=CC=CC=C4C3)O[C@@H]12)C(=O)NCCC(=O)NCCO
InChIKey
InChIKey=KWSJOQKPVOIUTQ-WULVCTAUSA-N
Formula
C43H52N2O8
Mass
724.895
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
- Subclass Sesquiterpenoids
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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
Sesquiterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Sesquiterpenoids
Alternative Parents
Beta amino acids and derivatives Benzoic acid esters Indanes Benzoyl derivatives N-acylethanolamines Ketals 1,3-dioxolanes Secondary carboxylic acid amides Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Epoxides Dialkyl ethers Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Sesquiterpenoid - Caryophyllane sesquiterpenoid - Beta amino acid or derivatives - Benzoate ester - Benzoic acid or derivatives - Indane - N-acylethanolamine - Benzoyl - Ketal - Benzenoid - Monocyclic benzene moiety - Meta-dioxolane - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Alkanolamine - Monocarboxylic acid or derivatives - Acetal - Ether - Oxirane - Dialkyl ether - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Organic oxide - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Primary alcohol - Organopnictogen compound - Alcohol - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units.
External Descriptors
Not available