Structure Information
Structure

Compound Identification

SMILES

CC(=O)OC1CC2(O)C3CCC4CC(CCC4(C)C3CCC2(C)C1C1=COC(=O)C=C1)OC(=O)CCC(=O)NC(CCCN=C(N)N)C(O)=O

InChIKey

InChIKey=ZHIFTHYTXVBJCZ-UHFFFAOYSA-N

Formula

C36H52N4O10

Mass

700.83

Export to:

JSON SDF CSV

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

Bufanolides and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Bufanolide-skeleton - Steroid ester - 14-hydroxysteroid - Hydroxysteroid - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - Alpha-amino acid or derivatives - Tricarboxylic acid or derivatives - Pyranone - N-acyl-amine - Fatty amide - Fatty acyl - Pyran - Cyclic alcohol - Heteroaromatic compound - Tertiary alcohol - Guanidine - Carboxylic acid ester - Secondary carboxylic acid amide - Lactone - Carboxamide group - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organopnictogen compound - Alcohol - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

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

External Descriptors

Not available

Previous Back Next