Structure Information
Structure

Compound Identification

SMILES

[Na+].[Na+].CC1(C)[C@H](CC[C@@]2(C)C1CC[C@]1(C)C2C(=O)C=C2[C@H]3C[C@@](C)(CC[C@]3(C)CC[C@@]12C)C([O-])=O)OC(=O)C1=CC=CC=C1C([O-])=O

InChIKey

InChIKey=INOXKZRJJCCHEM-AONLVFIFSA-L

Formula

C38H48Na2O7

Mass

662.775

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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

Triterpenoids

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Triterpenoid - Benzoate ester - Tricarboxylic acid or derivatives - Benzoic acid - Benzoic acid or derivatives - Benzoyl - Cyclohexenone - Fatty acid ester - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Alpha,beta-unsaturated ketone - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Enone - Acryloyl-group - Ketone - Carboxylic acid salt - Carboxylic acid ester - Organic alkali metal salt - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic sodium salt - Organic salt - Organooxygen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units.

External Descriptors

Not available

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