Compound Identification
SMILES
CC[C@H]1[C@H]2[C@@H](CCC[N@@H+]3[C@@H](CC[C@@H]23)[C@@H]2C[C@H](C)C(=O)O2)O[C@@]11OC(=O)[C@H](C)[C@H]1O
InChIKey
InChIKey=BSPUHYSQEMPWMI-NYENQNTGSA-O
Formula
C22H34NO6
Mass
408.514
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Stemona alkaloids
-
Subclass
Stemoamide-type alkaloids
- Level 5 Stichoneurine-type alkaloids
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Subclass
Stemoamide-type alkaloids
-
Class
Stemona alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Stemona alkaloids
Subclass
Stemoamide-type alkaloids
Intermediate Tree Nodes
Not available
Direct Parent
Stichoneurine-type alkaloids
Alternative Parents
Azepanes Ketals Dicarboxylic acids and derivatives Gamma butyrolactones N-alkylpyrrolidines Tetrahydrofurans Amino acids and derivatives Trialkylamines Carboxylic acid esters Secondary alcohols Oxacyclic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organopnictogen compounds Organic oxides Organic cations
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Stichoneurine-type alkaloid - Azepane - Ketal - Dicarboxylic acid or derivatives - Gamma butyrolactone - N-alkylpyrrolidine - Pyrrolidine - Tetrahydrofuran - Amino acid or derivatives - Carboxylic acid ester - Lactone - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Acetal - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Alcohol - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Organic cation - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as stichoneurine-type alkaloids. These are stemona alkaloids with a structure that typically contains a 3-methyloxolan-2-one and a 5-propyloxolan-2-one moieties that are attached to the characteristic pyrrolo[1,2-a]azepine skeleton at the C3 and C9 position, respectively.
External Descriptors
Not available