Compound Identification
SMILES
CCCCCCCCCCCCCCCC(=O)O[C@H]1C[C@H](C[C@@]23O[C@]2([C@H]2O[C@@]2(O3)[C@@H]([C@@H]2OC(=O)C1=C2)C(C)=C)C(=O)OC)C(C)=C
InChIKey
InChIKey=QVTVESXGEJHBTQ-JNWNXVASSA-N
Formula
C37H54O9
Mass
642.83
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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 Tricarboxylic acids and derivatives Fatty acid esters Oxirane carboxylic acids Monosaccharides Butenolides 1,3-dioxanes Oxolanes Methyl esters Enoate esters Lactones Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Diterpene lactone - Pseudopterane diterpenoid - Diterpenoid - Ileabethane, pseudopterane or nor-sandresane diterpenoid - Tricarboxylic acid or derivatives - Fatty acid ester - Meta-dioxane - 2-furanone - Monosaccharide - Oxirane carboxylic acid - Oxirane carboxylic acid or derivatives - Fatty acyl - Oxolane - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Dihydrofuran - Lactone - Carboxylic acid ester - Carboxylic acid derivative - Organoheterocyclic compound - Oxirane - Oxacycle - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - 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