Compound Identification
SMILES
CC1CCC2=C(C=CC=N2)C(=O)OCC2(C)OC34C(O)C2C(OC(C)=O)C(OC(C)=O)C3(COC(C)=O)C(OC(=O)C2=CC=CC=C2)C(OC(C)=O)C(OC1=O)C4(C)O
InChIKey
InChIKey=ZJRDCQWLAILQHR-UHFFFAOYSA-N
Formula
C41H47NO17
Mass
825.817
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
- Subclass Terpene lactones
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Class
Prenol lipids
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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
Agarofurans Benzoic acid esters Pyridinecarboxylic acids Benzoyl derivatives Oxepanes Monosaccharides Tetrahydrofurans Tertiary alcohols Heteroaromatic compounds Secondary alcohols Carboxylic acid esters Cyclic alcohols and derivatives Lactones Dialkyl ethers Oxacyclic compounds Azacyclic compounds Carbonyl compounds Organonitrogen compounds Hydrocarbon derivatives Organopnictogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Terpene lactone - Agarofuran - Sesquiterpenoid - Benzoate ester - Benzoic acid or derivatives - Pyridine carboxylic acid - Benzoyl - Oxepane - Monocyclic benzene moiety - Monosaccharide - Pyridine - Benzenoid - Heteroaromatic compound - Tetrahydrofuran - Tertiary alcohol - Cyclic alcohol - Secondary alcohol - Carboxylic acid ester - Lactone - Azacycle - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Dialkyl ether - Organic nitrogen compound - Alcohol - Organonitrogen compound - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - 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