Structure Information
Structure

Compound Identification

SMILES

C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2\C(C[C@@H](C[C@]12C)C=C)=C\C=C1\C[C@@H](O)C[C@H](O)C1=C

InChIKey

InChIKey=BQXISMVARCQSMW-AOFGDPGASA-N

Formula

C29H46O3

Mass

442.684

Export to:

JSON SDF CSV

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 homopolycyclic compounds

Substituents

Triterpenoid - Tertiary alcohol - Cyclic alcohol - Secondary alcohol - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aliphatic homopolycyclic 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

LIPIDMAPS (LMST03020405) : Vitamin D3 and derivatives

Previous Back Next