Structure Information
Structure

Compound Identification

SMILES

CCC1C2CC3C4N(C)C5=C(C=CC=C5)C44CC(C2C4O)[N]3(CC(=O)OC2CCC3(C)C(CCC4C3CCC3(C)C(CCC43O)C3=CC(=O)OC3)C2)C1O

InChIKey

InChIKey=LMPMKEYSYMTMSP-UHFFFAOYSA-N

Formula

C45H61N2O7

Mass

741.99

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Steroid lactones

Intermediate Tree Nodes

Not available

Direct Parent

Cardenolides and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cardanolide-skeleton - Steroid ester - Sarpagine-skeleton - 14-hydroxysteroid - Hydroxysteroid - Alpha-amino acid ester - Beta-carboline - Pyridoindole - Alpha-amino acid or derivatives - Quinolizidine - Indole or derivatives - Alkaloid or derivatives - Tertiary aliphatic/aromatic amine - Quinuclidine - Dialkylarylamine - Azepane - Aralkylamine - Benzenoid - Dicarboxylic acid or derivatives - 2-furanone - Piperidine - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Cyclic alcohol - Tertiary alcohol - Dihydrofuran - Tertiary amine - Lactone - Hemiaminal - Amino acid or derivatives - Secondary alcohol - Carboxylic acid ester - Alkanolamine - Oxacycle - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Amine - Carbonyl group - Organic oxygen compound - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cardenolides and derivatives. These are steroid lactones containing a furan-2-one moiety linked to the C17 atom of a cyclopenta[a]phenanthrene derivative.

External Descriptors

Not available

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