Structure Information
Structure

Compound Identification

SMILES

[Ca++].C\C(=C/C=C/[C@@]1(C)OC(=O)[C@@]23CC[C@@H]1[C@@]2([O-])CCC(=CC3)C(=O)N1CCNCC1)C([O-])=O

InChIKey

InChIKey=RHUMQFIHXLDQCV-KLGSBLKISA-M

Formula

C24H30CaN2O6

Mass

482.59

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Terpene lactones

Intermediate Tree Nodes

Not available

Direct Parent

Diterpene lactones

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Diterpene lactone - Diterpenoid - Prenyldaucane diterpenoid - Caprolactone - Medium-chain fatty acid - Delta valerolactone - Delta_valerolactone - Oxepane - Fatty acyl - Fatty acid - 1,4-diazinane - Dicarboxylic acid or derivatives - Oxane - Piperazine - Unsaturated fatty acid - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Carboxylic acid salt - Lactone - Amino acid or derivatives - Amino acid - Tertiary amine - Carboxylic acid derivative - Secondary amine - Oxacycle - Azacycle - Organic calcium salt - Carboxylic acid - Secondary aliphatic amine - Organoheterocyclic compound - Organic oxide - Organic salt - Organic oxygen compound - Amine - Organic nitrogen compound - Organic zwitterion - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Alkoxide - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as diterpene lactones. These are diterpenoids containing a lactone moiety.

External Descriptors

Not available

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