Compound Identification
SMILES
CCOC(=O)[C@@]12CCCC[C@@]11N(CCCC3=C1C=C(CC)O3)C(=O)[C@H]2SCC
InChIKey
InChIKey=NSMPSXYUBBBABF-COPCDDAFSA-N
Formula
C22H31NO4S
Mass
405.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Erythrina alkaloids
- Subclass Homoerythrinane alkaloids
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Class
Erythrina alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Erythrina alkaloids
Subclass
Homoerythrinane alkaloids
Intermediate Tree Nodes
Not available
Direct Parent
Homoerythrinane alkaloids
Alternative Parents
Indoles and derivatives Pyrrolidine carboxylic acids Azepines Pyrrolidine-2-ones N-alkylpyrrolidines Tertiary carboxylic acid amides Furans Heteroaromatic compounds Carboxylic acid esters Lactams Azacyclic compounds Sulfenyl compounds Oxacyclic compounds Dialkylthioethers Monocarboxylic acids and derivatives Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Heteroaromatic homoerythrinane skeleton - Indole or derivatives - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Azepine - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Furan - Heteroaromatic compound - Pyrrolidine - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactam - Dialkylthioether - Organoheterocyclic compound - Sulfenyl compound - Thioether - Carboxylic acid derivative - Azacycle - Oxacycle - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as homoerythrinane alkaloids. These are erythrina alkaloids predominantly possessing a 6-5-7-6-membered indolobenzazepine skeleton or a derivative thereof.
External Descriptors
Not available