Compound Identification
SMILES
CC12CCC3C(CC3(C)C)C(CCC1O2)=CC1=CC=CC=C1C(=O)OC1CC(=CC2OC3(CC4=CC=CC=C4C3)OC12)C(=O)NCC1=CC=CC(=C1)C(=O)NCCO
InChIKey
InChIKey=HGDYAJWLUPHHHT-UHFFFAOYSA-N
Formula
C48H54N2O8
Mass
786.966
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
Benzoic acid esters Benzamides Indanes N-acylethanolamines Benzoyl derivatives 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 - Benzoate ester - Benzamide - Benzoic acid or derivatives - Indane - Benzoyl - N-acylethanolamine - Ketal - Monocyclic benzene moiety - Benzenoid - Meta-dioxolane - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid ester - Acetal - Alkanolamine - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Oxirane - Ether - Monocarboxylic acid or derivatives - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Primary alcohol - Organic oxide - Hydrocarbon derivative - Alcohol - Organooxygen compound - Organopnictogen compound - Organonitrogen compound - 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