Compound Identification
SMILES
COC1=CC2=C(C=C1)[C@H]1CC[C@]3(C)C(=O)[C@H]4CC[C@@]3(C4)[C@@H]1CC2
InChIKey
InChIKey=FSQFAHHTTDRDIV-LLKJBZILSA-N
Formula
C21H26O2
Mass
310.437
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Lipids and lipid-like molecules
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
Phenanthrenes and derivatives Tetralins Aromatic monoterpenoids Anisoles Alkyl aryl ethers Ketones Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Steroid - Phenanthrene - Aromatic monoterpenoid - Norbornane monoterpenoid - Monoterpenoid - Tetralin - Anisole - Phenol ether - Alkyl aryl ether - Benzenoid - Ketone - Ether - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic homopolycyclic 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