Structure Information
Structure

Compound Identification

SMILES

[H][C@](O)(C(=O)OC)[C@@]1([H])C(C)(C)C(=O)C[C@]2([H])O[C@]34CC(=O)O[C@@]([H])(C5=COC=C5)[C@@]3(C)CC[C@@]([H])(C4=C)[C@]12C

InChIKey

InChIKey=GOYZKWCPWBKPIG-HGOWJASLSA-N

Formula

C27H34O8

Mass

486.561

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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

Aromatic heteropolycyclic compounds

Substituents

Limonoid skeleton - Delta valerolactone - Delta_valerolactone - Dicarboxylic acid or derivatives - Oxane - Furan - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Ketone - Lactone - Cyclic ketone - Secondary alcohol - Oxacycle - Ether - Dialkyl ether - Organoheterocyclic compound - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organooxygen compound - Alcohol - Aromatic 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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