Compound Identification
SMILES
C[C@]12CC[C@H]3[C@@H](CC[C@@H]4C[C@H]5NC[C@H](O5)[C@]34C)[C@@H]1C[C@@H]1OC(=O)C[C@H]21
InChIKey
InChIKey=GUSZSGSYIVZEDM-MZDLDJOOSA-N
Formula
C21H31NO3
Mass
345.483
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Steroids and steroid derivatives
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Subclass
Steroidal alkaloids
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Level 5
Samamine-type alkaloids
- Level 6 Samandarines
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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
Samamine-type alkaloids
Direct Parent
Samandarines
Alternative Parents
Azasteroids and derivatives Oxasteroids and derivatives Naphthopyrans Naphthalenes Alkaloids and derivatives Azepanes Pyrans Gamma butyrolactones Oxanes Oxolanes Oxazolidines Hemiaminals Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organopnictogen compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Samandarin skeleton - Azasteroid - 2-oxasteroid - Naphthopyran - Naphthalene - Alkaloid or derivatives - Azepane - Gamma butyrolactone - Oxane - Pyran - Oxolane - Oxazolidine - Carboxylic acid ester - Hemiaminal - Lactone - Azacycle - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organopnictogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as samandarines. These are samamime-type alkaloids in which the A-ring of the steroidal backbone is an oxazolidine.
External Descriptors
Not available