Structure Information
Structure

Compound Identification

SMILES

CCC\C=C\C=C\C=CC(=O)O[C@H]1CC[C@]2(C)[C@@H]3CC[C@@]45C[C@@]4(CC[C@@H]5[C@@H]4C[C@@H](O[C@H]4O)[C@H]4OC4(C)C)[C@@]3(C)[C@@H](O)C[C@@H]2C1(C)C

InChIKey

InChIKey=UKWBVCZXHCPFHC-UKJWYBKJSA-N

Formula

C40H60O6

Mass

636.914

Export to:

JSON SDF CSV

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

Limonoid skeleton - Steroid ester - 7-alpha-hydroxysteroid - Hydroxysteroid - Steroid - Fatty acid ester - Fatty acyl - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tetrahydrofuran - Cyclic alcohol - Secondary alcohol - Hemiacetal - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Ether - Oxirane - Dialkyl ether - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - 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

Previous Back Next