Compound Identification
SMILES
C[C@]12C[C@@H]3OC33C(C1CC[C@@]21CCC(=O)O1)[C@@H](CC1=CC(=O)CC[C@]31C)C(N)=O
InChIKey
InChIKey=UDIIQNDHXNJDME-XHIFQYCZSA-N
Formula
C23H29NO5
Mass
399.487
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
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Subclass
Steroid lactones
- Level 5 Spironolactones and derivatives
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Subclass
Steroid lactones
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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
Steroid lactones
Intermediate Tree Nodes
Not available
Direct Parent
Spironolactones and derivatives
Alternative Parents
Naphthalenecarboxamides Oxepanes Cyclohexenones Gamma butyrolactones Oxolanes Primary carboxylic acid amides Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Epoxides Dialkyl ethers Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Spironolactone - 2-naphthalenecarboxamide - 1-naphthalenecarboxamide - Cyclohexenone - Oxepane - Gamma butyrolactone - Oxolane - Carboxamide group - Carboxylic acid ester - Ketone - Lactone - Cyclic ketone - Primary carboxylic acid amide - Carboxylic acid derivative - Dialkyl ether - Oxirane - Ether - Oxacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as spironolactones and derivatives. These are steroid lactones with a structure based on the spironolactone skeleton.
External Descriptors
Not available