Structure Information
Structure

Compound Identification

SMILES

CC(O)CCCCCC(CCCCCCCCCCCCCC(CC(=O)OC[C@H]1O[C@@H](OC2CCCCCCCCCCCC(CCCCCC(C)O)O[C@H]3O[C@H](COC(=O)CC(CCCCCCCCCCCC(CCCCCC(C)O)OC4O[C@H](COC(=O)C2)[C@@H](O)[C@H](O)[C@H]4O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@@H](O)[C@@H]1O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

InChIKey

InChIKey=IRGFQIKHGZEGDT-DRSYKHPXSA-N

Formula

C104H190O42

Mass

2112.622

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Fatty Acyls

Subclass

Fatty acyl glycosides

Intermediate Tree Nodes

Not available

Direct Parent

Rhamnolipids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Mono-rhamnolipid - Rhamnolipid - Saccharolipid - Fatty acyl glycoside of mono- or disaccharide - Macrolide - Alkyl glycoside - Glycosyl compound - O-glycosyl compound - Fatty alcohol - Tricarboxylic acid or derivatives - Fatty acid ester - Sugar acid - Oxane - Monosaccharide - Secondary alcohol - Lactone - Carboxylic acid ester - Polyol - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Acetal - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Alcohol - Carbonyl group - Organic oxygen compound - Primary alcohol - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as rhamnolipids. These are glycolipids structurally characterized by a glycosyl head group, in this case a rhamnose moiety, and a 3-(hydroxyalkanoyloxy)alkanoic acid (HAA) fatty acid tail.

External Descriptors

Not available

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