Compound Identification
SMILES
COC(=O)[C@@]12OC11CC([C@@H](O)[C@@H](O)C3=C[C@@H](OC3=O)[C@@H](C(C)=C)C3(OC23)O1)C(C)=C
InChIKey
InChIKey=AHVHTEQZHUAMTF-OZHMAXQPSA-N
Formula
C21H24O9
Mass
420.414
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
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Subclass
Terpene lactones
- Level 5 Diterpene 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
Not available
Direct Parent
Diterpene lactones
Alternative Parents
Ileabethane, pseudopterane or nor-sandresane diterpenoids 1,3-dioxanes Oxirane carboxylic acids Butenolides Dicarboxylic acids and derivatives Monosaccharides Oxolanes Methyl esters Enoate esters 1,2-diols Secondary alcohols Lactones Oxacyclic compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Pseudopterane diterpenoid - Diterpene lactone - Ileabethane, pseudopterane or nor-sandresane diterpenoid - Diterpenoid - Meta-dioxane - 2-furanone - Dicarboxylic acid or derivatives - Oxirane carboxylic acid or derivatives - Oxirane carboxylic acid - Monosaccharide - Dihydrofuran - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Oxolane - 1,2-diol - Carboxylic acid ester - Secondary alcohol - Lactone - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Oxirane - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Alcohol - Organooxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as diterpene lactones. These are diterpenoids containing a lactone moiety.
External Descriptors
Not available