Compound Identification
SMILES
CCCCO[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(O)[C@H]3CC[C@]12C
InChIKey
InChIKey=GLAWPRNOLUYCBS-KKFDQILXSA-N
Formula
C22H32O3
Mass
344.495
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Steroids and steroid derivatives
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Subclass
Estrane steroids
- Level 5 Estrogens and derivatives
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Subclass
Estrane steroids
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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
Estrane steroids
Intermediate Tree Nodes
Not available
Direct Parent
Estrogens and derivatives
Alternative Parents
Hydroxysteroids 3-oxo delta-1,4-steroids Delta-1,4-steroids Tertiary alcohols Cyclic ketones Cyclic alcohols and derivatives Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Estrogen-skeleton - 3-oxo-delta-1,4-steroid - 3-oxosteroid - 10-hydroxysteroid - Oxosteroid - Hydroxysteroid - Delta-1,4-steroid - Cyclic alcohol - Tertiary alcohol - Cyclic ketone - Ketone - Ether - Dialkyl ether - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Alcohol - Organooxygen compound - Aliphatic 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