Structure Information
Structure

Compound Identification

SMILES

CC1(C)CCC[C@@]2(C)C1CC[C@@]1(C)[C@H](\C=C\C3=CC(=O)OC3O)[C@H](CCC21)C(O)=O

InChIKey

InChIKey=QBUNBRGDEZXPAU-KOIUIHBFSA-N

Formula

C25H36O5

Mass

416.558

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Sesterterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Cheilanthane sesterterpenoids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Cheilanthane sesterterpenoid - Hydroxysteroid - 17-oxosteroid - Oxosteroid - 17-hydroxysteroid - Steroid - Hydrophenanthrene - Phenanthrene - 2-furanone - Dicarboxylic acid or derivatives - Dihydrofuran - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Lactone - Hemiacetal - Carboxylic acid ester - Organoheterocyclic compound - Oxacycle - Carboxylic acid - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Carbonyl group - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cheilanthane sesterterpenoids. These are sesterterpnoids with a structure based on the cheilanthane backbone. Cheilanthane is a tricyclic compound consisting of a tetradecahydrophenanthrene ring system that carries two methyl groups at the 1-position, one methyl group at the 4a-,7-, and 8a-positions, as well as a 3-methylpentyl group at the 8-position.

External Descriptors

Not available

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