Structure Information
Structure

Compound Identification

SMILES

COC(=O)C[C@H]1[C@]2(C)C[C@@]3(O)[C@]1(C)[C@H]1CC[C@@]4(C)[C@@H](OC(=O)CC4=C1C(=O)[C@@]3(OC)[C@H]2OC(C)=O)C1=COC=C1

InChIKey

InChIKey=DXAWUJPEJQPCGT-IQXSIFHKSA-N

Formula

C30H36O10

Mass

556.608

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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 - Prostaglandin skeleton - Steroid lactone - Eicosanoid - 2-oxosteroid - Oxosteroid - 11-oxosteroid - Steroid - 3-oxasteroid - Naphthopyran - Naphthalene - Tricarboxylic acid or derivatives - Delta valerolactone - Delta_valerolactone - Fatty acyl - Oxane - Pyran - Cyclic alcohol - Furan - Heteroaromatic compound - Methyl ester - Tertiary alcohol - Lactone - Ketone - Carboxylic acid ester - Ether - Dialkyl ether - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alcohol - Organooxygen compound - 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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