Compound Identification
SMILES
CN1C(=O)[C@]23CC4=C(N2C(=O)[C@]1(CO)SS3)C(O)=CC=C4
InChIKey
InChIKey=BNNLUYCZQNYABS-OLZOCXBDSA-N
Formula
C13H12N2O4S2
Mass
324.37
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indolecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Indolecarboxylic acids and derivatives
Alternative Parents
Epipolythiodioxopiperazines Alpha amino acids and derivatives N-methylpiperazines 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Dithiazinanes Tertiary carboxylic acid amides Tertiary amines Organic disulfides Lactams Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolecarboxylic acid derivative - Alpha-amino acid or derivatives - Epipolythiodioxopiperazine - Thiodioxopiperazine - Dioxopiperazine - 2,5-dioxopiperazine - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - N-methylpiperazine - N-alkylpiperazine - 1,4-diazinane - Dithiazinane - Piperazine - Benzenoid - Tertiary carboxylic acid amide - Amino acid or derivatives - Tertiary amine - Carboxamide group - Organic disulfide - Lactam - Azacycle - Carboxylic acid derivative - Primary alcohol - Organic oxide - Organic oxygen compound - Alcohol - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indolecarboxylic acids and derivatives. These are compounds containing a carboxylic acid group (or a derivative thereof) linked to an indole.
External Descriptors
Not available