Structure Information
Structure

Compound Identification

SMILES

CCC(=O)OC1[C@@H]2CC3=C4CC(=O)O[C@@H](C5=COC=C5)[C@]4(C)CCC3C(C)([C@@H](CC(=O)OC)C1(C)C)C2=O

InChIKey

InChIKey=SXDJQLIGPRXBTP-NODCUZSVSA-N

Formula

C30H38O8

Mass

526.626

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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

Mexicanolide - Limonoid skeleton - Naphthopyran - Naphthalene - Tricarboxylic acid or derivatives - Delta_valerolactone - Delta valerolactone - Pyran - Oxane - Heteroaromatic compound - Methyl ester - Furan - Lactone - Ketone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - 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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