Compound Identification
SMILES
[H][C@]12C[C@]3([H])[C@]4([H])C[C@@]([H])(O)[C@]5([H])CCNCC[C@]5(C)[C@@]4([H])CC[C@]3(C)[C@@]1([H])CC(=O)O2
InChIKey
InChIKey=FAOBWDLDASSTHV-SUGPMWQHSA-N
Formula
C21H33NO3
Mass
347.499
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
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Subclass
Steroidal alkaloids
- Level 5 Samamine-type alkaloids
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Subclass
Steroidal alkaloids
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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
Steroidal alkaloids
Intermediate Tree Nodes
Not available
Direct Parent
Samamine-type alkaloids
Alternative Parents
Azasteroids and derivatives Alkaloids and derivatives Azepanes Gamma butyrolactones Tetrahydrofurans Secondary alcohols Amino acids and derivatives Carboxylic acid esters Cyclic alcohols and derivatives Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Dialkylamines Organopnictogen compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Samamine skeleton - Azasteroid - Alkaloid or derivatives - Azepane - Gamma butyrolactone - Cyclic alcohol - Tetrahydrofuran - Amino acid or derivatives - Carboxylic acid ester - Lactone - Secondary alcohol - Carboxylic acid derivative - Secondary aliphatic amine - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Secondary amine - Hydrocarbon derivative - Organic oxide - Alcohol - Amine - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Carbonyl group - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as samamine-type alkaloids. These are alkaloids with a structure that is based on the samamine skeleton, a tetracyclic compound consisting of and azepane ring fuse a saturated cyclopenta[a]naphthalene derivative.
External Descriptors
Not available