Compound Identification
SMILES
COC(=O)[C@@]12CC(=O)CC[C@]11N(CC[C@@H](SC3=CC=CC=C3)C3=CC(OC)=C(OC)C=C13)C(=O)[C@@H]2OS(C)(=O)=O
InChIKey
InChIKey=OFQXFGJKOWJXKX-YFQNEARWSA-N
Formula
C28H31NO9S2
Mass
589.67
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Erythrina alkaloids
- Subclass Homoerythrinane alkaloids
-
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
Benzazepines Indoles and derivatives Thiophenol ethers Anisoles Pyrrolidine carboxylic acids Alkyl aryl ethers Alkylarylthioethers Azepines Sulfonic acid esters Pyrrolidine-2-ones Benzene and substituted derivatives Organosulfonic acid esters N-alkylpyrrolidines Methanesulfonates Tertiary carboxylic acid amides Sulfonyls Methyl esters Lactams Cyclic ketones Azacyclic compounds Monocarboxylic acids and derivatives Sulfenyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Homoerythrinane skeleton - Benzazepine - Indole or derivatives - Pyrrolidine carboxylic acid or derivatives - Thiophenol ether - Pyrrolidine carboxylic acid - Phenol ether - Aryl thioether - Anisole - Alkyl aryl ether - Alkylarylthioether - Azepine - N-alkylpyrrolidine - Pyrrolidone - 2-pyrrolidone - Benzenoid - Sulfonic acid ester - Monocyclic benzene moiety - Organosulfonic acid ester - Methanesulfonate - Methyl ester - Pyrrolidine - Tertiary carboxylic acid amide - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Carboxamide group - Carboxylic acid ester - Cyclic ketone - Ketone - Lactam - Azacycle - Thioether - Sulfenyl compound - Carboxylic acid derivative - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Organosulfur compound - Carbonyl group - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen 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