Compound Identification
SMILES
COC(=O)C1=CC2=C(CCN3C(=O)[C@@H](OS(C)(=O)=O)[C@@]4(C=CC(=O)C[C@]234)C(=O)OC)C(=O)O1
InChIKey
InChIKey=USQLECIKOBSFDN-VOBQZIQPSA-N
Formula
C20H19NO11S
Mass
481.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Erythrina alkaloids
- Subclass Erythrinanes
-
Class
Erythrina alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Erythrina alkaloids
Subclass
Erythrinanes
Intermediate Tree Nodes
Not available
Direct Parent
Erythrinanes
Alternative Parents
Indoles and derivatives Pyrrolidine carboxylic acids Cyclohexenones Pyranones and derivatives Sulfonic acid esters Pyrrolidine-2-ones N-alkylpyrrolidines Organosulfonic acid esters Sulfonyls Heteroaromatic compounds Tertiary carboxylic acid amides Methanesulfonates Methyl esters Lactones Lactams Tertiary amines Amino acids and derivatives Azacyclic compounds Monocarboxylic acids and derivatives Oxacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Heteroaromatic erythrinane skeleton - Indole or derivatives - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Pyranone - Cyclohexenone - Pyran - Pyrrolidone - 2-pyrrolidone - Sulfonic acid ester - N-alkylpyrrolidine - Organosulfonic acid ester - Methanesulfonate - Heteroaromatic compound - Pyrrolidine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Methyl ester - Sulfonyl - Tertiary carboxylic acid amide - Tertiary amine - Carboxylic acid ester - Carboxamide group - Cyclic ketone - Ketone - Lactam - Lactone - Amino acid or derivatives - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Azacycle - Organonitrogen compound - Amine - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as erythrinanes. These are erythrina alkaloids possessing either a 6-5-6-6-membered indoloisoquinoline core or a derivative thereof.
External Descriptors
Not available