Compound Identification
SMILES
[Cl-].C[C@H]1CC[C@@H]2[NH+](C1)CC1C3C[C@@]45O[C@@]6(O)C(C[C@@H](O)C4[C@]3(O)[C@@H](O)[C@H](O)C1[C@]2(C)O)[C@]5(C)CC[C@@H]6O
InChIKey
InChIKey=JLXCGRYYCQIBKO-ADWSFURMSA-N
Formula
C27H44ClNO8
Mass
546.1
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
- Level 5 Cerveratrum-type alkaloids
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Subclass
Steroidal alkaloids
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Class
Steroids and steroid derivatives
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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
Cerveratrum-type alkaloids
Alternative Parents
Azasteroids and derivatives Quinolizidines Alkaloids and derivatives Oxepanes Piperidines Tetrahydrofurans Tertiary alcohols Trialkylamines Secondary alcohols 1,2-aminoalcohols Cyclic alcohols and derivatives Hemiacetals Polyols Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organic zwitterions Organic chloride salts Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Cerveratrum-type alkaloid - Azasteroid - Quinolizidine - Alkaloid or derivatives - Oxepane - Piperidine - Cyclic alcohol - Tertiary alcohol - Tetrahydrofuran - 1,2-aminoalcohol - Hemiacetal - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Azacycle - Polyol - Oxacycle - Organoheterocyclic compound - Organic chloride salt - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Alcohol - Organopnictogen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Organic zwitterion - Organic salt - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cerveratrum-type alkaloids. These are steroidal alkaloids containing the cevane (23-methyl-4- azahexacyclo[12.11.0.0^{2,11}.0^{4,9}.0^{15,24}.0^{18,23}]pentacosane) moiety, which is a six ring system. Cerveratrum alkaloids have 7-9 oxygen atoms and occur as free alkamines or esters of simple aliphatic or aromatic acids.
External Descriptors
Not available