Compound Identification
SMILES
COC(=O)C1[C@H]2CC(=O)C(CCC=C)[C@@H]([C@H]([C@H]2OC1=O)C(=O)OC)C(=O)OC
InChIKey
InChIKey=UMUMSOBOIDKOHL-HVUGMSMJSA-N
Formula
C19H24O9
Mass
396.392
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
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Subclass
Terpene lactones
-
Level 5
Sesquiterpene lactones
- Level 6 Xanthanolides
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Level 5
Sesquiterpene lactones
-
Subclass
Terpene lactones
-
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
Sesquiterpene lactones
Direct Parent
Xanthanolides
Alternative Parents
Sesquiterpenoids Tetracarboxylic acids and derivatives Gamma butyrolactones 1,3-dicarbonyl compounds Oxolanes Methyl esters Cyclic ketones Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Xanthanolide-skeleton - Sesquiterpenoid - Xanthane sesquiterpenoid - Tetracarboxylic acid or derivatives - Gamma butyrolactone - 1,3-dicarbonyl compound - Oxolane - Methyl ester - Carboxylic acid ester - Ketone - Lactone - Cyclic ketone - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Organic oxide - Organooxygen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as xanthanolides. These are sesquiterpenoids with a structure based on the xanthanolide skeleton consistsing of a cycloheptane ring usually attached to a four-carbon chain (at carbon 1 ) and a methyl group (at carbon 10), and fused to a five-member lactone ring (sharing carbons 7 and 8). The lactone ring can be conjugated with a methyl or methylene group at position 11.
External Descriptors
Not available