Structure Information
Structure

Compound Identification

SMILES

COC1=CC2=C(C=C1)C1[C@H](C[C@]3(C)[C@H](CC[C@H]3[C@]1(C)CC2)O[C@@H]1CCCCO1)C1=CC=C(OCCCCCCl)C=C1

InChIKey

InChIKey=JTULVPZHWYZATQ-DXEDCKFFSA-N

Formula

C36H49ClO4

Mass

581.23

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Steroids and steroid derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Steroid - Phenanthrene - Tetralin - Phenoxy compound - Anisole - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Oxane - Benzenoid - Ether - Acetal - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Organooxygen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Alkyl halide - Alkyl chloride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as steroids and steroid derivatives. These are compounds based on the cyclopenta[a]phenanthrene carbon skeleton, partially or completely hydrogenated; there are usually methyl groups at C-10 and C-13, and often an alkyl group at C-17. By extension, one or more bond scissions, ring expansions and/or ring contractions of the skeleton may have occurred.

External Descriptors

Not available

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