Structure Information
Structure

Compound Identification

SMILES

[I-].[I-].C[C@H](CCC(=O)NCCC[N+]1(C)CC[N+](C)(C)CC1)[C@H]1CCC2C3CC[C@@H]4C[C@H](O)CC[C@]4(C)C3CC[C@]12C

InChIKey

InChIKey=APFOLQPXZRHTLE-YGSHSALASA-M

Formula

C34H63I2N3O2

Mass

799.706

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Vitamin D and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Vitamin D and derivatives

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Triterpenoid - Monohydroxy bile acid, alcohol, or derivatives - Hydroxy bile acid, alcohol, or derivatives - Bile acid, alcohol, or derivatives - 3-alpha-hydroxysteroid - Hydroxysteroid - 3-hydroxysteroid - N-alkylpiperazine - N-methylpiperazine - Fatty acyl - Piperazine - N-acyl-amine - Fatty amide - 1,4-diazinane - Tetraalkylammonium salt - Quaternary ammonium salt - Cyclic alcohol - Secondary alcohol - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic iodide salt - Organic salt - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Amine - Alcohol - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as vitamin d and derivatives. These are compounds containing a secosteroid backbone, usually secoergostane or secocholestane.

External Descriptors

Not available

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