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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Vitamin D and derivatives
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Class
Steroids and steroid derivatives
-
Superclass
Lipids and lipid-like molecules
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
Triterpenoids Monohydroxy bile acids, alcohols and derivatives 3-alpha-hydroxysteroids N-methylpiperazines N-acyl amines Tetraalkylammonium salts Secondary alcohols Cyclic alcohols and derivatives Carboxylic acid amides Azacyclic compounds Organopnictogen compounds Organic zwitterions Organic oxides Organic iodide salts Hydrocarbon derivatives Amines
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