Compound Identification
SMILES
COC(=O)N1CC(C)CC2OC3(CCC4C5CC=C6CC(O)CCC6(C)C5C(O)C4=C3C)C(C)C12
InChIKey
InChIKey=WPMPQHGQKMKABD-UHFFFAOYSA-N
Formula
C29H43NO5
Mass
485.665
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
-
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 Piperidinecarboxylic acids Tetrahydrofurans Methylcarbamates Secondary alcohols Cyclic alcohols and derivatives Organic carbonic acids and derivatives Dialkyl ethers Azacyclic compounds Oxacyclic compounds Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organonitrogen compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Jerveratrum-type alkaloid - Azasteroid - Piperidinecarboxylic acid - Alkaloid or derivatives - Piperidine - Methylcarbamate - Cyclic alcohol - Tetrahydrofuran - Carbamic acid ester - Carbonic acid derivative - Secondary alcohol - Dialkyl ether - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Alcohol - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxygen 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