Compound Identification
SMILES
CC1C2C(CC(C)CN2C(C)=O)OC11CCC2C3CC=C4CC(CCC4(C)C3C(=O)C2=C1C)OC(C)=O
InChIKey
InChIKey=AETQSOZEKYWGIJ-UHFFFAOYSA-N
Formula
C31H43NO5
Mass
509.687
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 Jerveratrum-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
Jerveratrum-type alkaloids
Alternative Parents
Azasteroids and derivatives Alkaloids and derivatives N-acylpiperidines Tetrahydrofurans Tertiary carboxylic acid amides Acetamides Carboxylic acid esters Ketones Oxacyclic compounds Azacyclic compounds Dialkyl ethers Monocarboxylic acids and derivatives Organic oxides Organopnictogen compounds Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Jerveratrum-type alkaloid - Azasteroid - N-acyl-piperidine - Alkaloid or derivatives - Piperidine - Acetamide - Tertiary carboxylic acid amide - Tetrahydrofuran - Carboxamide group - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic nitrogen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as jerveratrum-type alkaloids. These are steroidal alkaloids with a structure that is based on the jervane ring system. Jerveratrum alkaloids have alkamines with 1-3 oxygen atoms, and occur as such or as monoglycosides.
External Descriptors
Not available