Compound Identification
SMILES
COC(=O)[C@@H]1CC(SC)C2=CC(OC)=C(OC)C=C2[C@@]23CCC(=O)C[C@]2(C(=O)OC)C(=O)C(=O)N13
InChIKey
InChIKey=OXTKETJCNHRWTN-XORSSZIKSA-N
Formula
C24H27NO9S
Mass
505.54
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
Alpha amino acid esters Benzazepines Indoles and derivatives Anisoles Pyrrolidine carboxylic acids Azepines Alkyl aryl ethers Pyrrolidine-3-ones Pyrrolidine-2-ones Dicarboxylic acids and derivatives N-alkylpyrrolidines Tertiary carboxylic acid amides Methyl esters Cyclic ketones Lactams Dialkylthioethers Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Homoerythrinane skeleton - Alpha-amino acid ester - Benzazepine - Alpha-amino acid or derivatives - Indole or derivatives - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine carboxylic acid - Phenol ether - Anisole - Alkyl aryl ether - Azepine - N-alkylpyrrolidine - 3-pyrrolidone - 2-pyrrolidone - Pyrrolidone - Benzenoid - Dicarboxylic acid or derivatives - Methyl ester - Tertiary carboxylic acid amide - Pyrrolidine - Carboxamide group - Carboxylic acid ester - Cyclic ketone - Ketone - Lactam - Thioether - Ether - Dialkylthioether - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Sulfenyl compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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