Compound Identification
SMILES
CC12CCCC1C1=C(C(=O)C2)C2=C(C=C1)C=C(O)C=C2
InChIKey
InChIKey=VPQIWSGBKBBXAH-UHFFFAOYSA-N
Formula
C18H18O2
Mass
266.34
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
-
Subclass
Estrane steroids
- Level 5 Estrogens and derivatives
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Subclass
Estrane steroids
-
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
Estrane steroids
Intermediate Tree Nodes
Not available
Direct Parent
Estrogens and derivatives
Alternative Parents
3-hydroxy delta-7-steroids 11-oxosteroids Delta-7-steroids Phenanthrols Naphthols and derivatives Tetralins Aryl alkyl ketones 1-hydroxy-2-unsubstituted benzenoids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Estrogen-skeleton - 3-hydroxy-delta-7-steroid - 3-hydroxysteroid - Hydroxysteroid - 11-oxosteroid - Oxosteroid - Delta-7-steroid - Phenanthrol - Phenanthrene - 2-naphthol - Tetralin - Naphthalene - Aryl ketone - Aryl alkyl ketone - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Benzenoid - Ketone - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as estrogens and derivatives. These are steroids with a structure containing a 3-hydroxylated estrane.
External Descriptors
Not available