Structure Information
Structure

Compound Identification

SMILES

CC(C)=C[C@@H]1O[C@H](O)[C@H]([C@@H]1O)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H]4[C@]5(C[C@@]35CC[C@]12C)CC[C@H](O)C4(C)C

InChIKey

InChIKey=WZYISXKEYZUNQE-LBXJHVLXSA-N

Formula

C30H48O4

Mass

472.71

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Triterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Limonoids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Cycloartanol-skeleton - Limonoid skeleton - 9b,19-cyclo-lanostane-skeleton - Cycloartane-skeleton - 22-hydroxysteroid - 3-hydroxysteroid - 3-beta-hydroxysteroid - Hydroxysteroid - Steroid - Pentose monosaccharide - Monosaccharide - Tetrahydrofuran - Cyclic alcohol - Secondary alcohol - Hemiacetal - Organoheterocyclic compound - Oxacycle - Organooxygen compound - Hydrocarbon derivative - Alcohol - Organic oxygen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as limonoids. These are highly oxygenated, modified terpenoids with a prototypical structure either containing or derived from a precursor with a 4,4,8-trimethyl-17-furanylsteroid skeleton. All naturally occurring citrus limonoids contain a furan ring attached to the D-ring, at C-17, as well as oxygen containing functional groups at C-3, C-4, C-7, C-16 and C-17.

External Descriptors

Not available

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