Structure Information
Structure

Compound Identification

SMILES

NC(CO)(CO)CO.CC(C)[C@]12O[C@H]1[C@H]1O[C@@]11[C@]3(O[C@H]3C[C@H]3C4=C(CC[C@]13C)C(=O)OC4)[C@@H]2OC(=O)CCC(O)=O

InChIKey

InChIKey=XASQYTBNKAPQRQ-NUFKFZQYSA-N

Formula

C28H39NO12

Mass

581.615

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Tricarboxylic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Tricarboxylic acids and derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

Tricarboxylic acid or derivatives - Fatty acid ester - Oxepane - 2-furanone - Fatty acyl - Dihydrofuran - Alpha,beta-unsaturated carboxylic ester - Enoate ester - 1,2-aminoalcohol - Carboxylic acid ester - Lactone - Carboxylic acid - Dialkyl ether - Oxirane - Ether - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Alcohol - Organic nitrogen compound - Organic oxide - Carbonyl group - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Primary amine - Primary alcohol - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as tricarboxylic acids and derivatives. These are carboxylic acids containing exactly three carboxyl groups.

External Descriptors

Not available

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