Compound Identification
SMILES
C[C@@H]1O[C@@H]2[C@H](C)C(=O)O[C@@H]2[C@@H]1[C@@H]1CCCC[N@@H+]2[C@@H](CC[C@@H]12)[C@@H]1C[C@H](C)C(=O)O1
InChIKey
InChIKey=NSVYJHREGGWCHW-HTHWTJBFSA-O
Formula
C22H34NO5
Mass
392.515
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Stemona alkaloids
-
Subclass
Stemoamide-type alkaloids
- Level 5 Stichoneurine-type alkaloids
-
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
Parvistemoline-type alkaloids Pyrroloazepines Furofurans Azepanes N-alkylpyrrolidines Gamma butyrolactones Dicarboxylic acids and derivatives Tetrahydrofurans Trialkylamines Amino acids and derivatives Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic cations
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Stichoneurine-type alkaloid - Parvistemoline backbone - Pyrroloazepine - Furofuran - Azepane - Dicarboxylic acid or derivatives - Gamma butyrolactone - N-alkylpyrrolidine - Pyrrolidine - Tetrahydrofuran - Amino acid or derivatives - Carboxylic acid ester - Lactone - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Azacycle - Ether - Organoheterocyclic compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - 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