Compound Identification
SMILES
C[C@@H]1[C@@H]2NC[C@@H](C)C[C@H]2O[C@]11CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC2=C1C)O[C@H]1[C@H]([O-])O[C@H](CO)[C@@H](O)[C@@H]1O
InChIKey
InChIKey=DZLGMWVVWVOGIM-PBFVMIKGSA-N
Formula
C33H50NO7
Mass
572.764
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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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 Hexoses Alkaloids and derivatives Piperidines Oxanes Oxolanes Secondary alcohols Azacyclic compounds Oxacyclic compounds Dialkyl ethers Dialkylamines Primary alcohols Alkoxides Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Jerveratrum-type alkaloid - Azasteroid - Hexose monosaccharide - Alkaloid or derivatives - Monosaccharide - Oxane - Piperidine - Oxolane - Secondary alcohol - Dialkyl ether - Secondary aliphatic amine - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Secondary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Primary alcohol - Amine - Alkoxide - Organic anion - 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