Compound Identification
SMILES
CN1C(=O)[C@@]23CC4=CC=C[C@@H](O)[C@H]4N2C(=O)[C@]1(CO)SS3
InChIKey
InChIKey=FIVPIPIDMRVLAY-PSJXJDHFSA-N
Formula
C13H14N2O4S2
Mass
326.39
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
-
Subclass
Piperazines
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Level 5
Dioxopiperazines
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Level 6
2,5-dioxopiperazines
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Level 7
Thiodioxopiperazines
- Level 8 Epipolythiodioxopiperazines
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Level 7
Thiodioxopiperazines
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Level 6
2,5-dioxopiperazines
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Level 5
Dioxopiperazines
-
Subclass
Piperazines
-
Class
Diazinanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Dioxopiperazines - 2,5-dioxopiperazines - Thiodioxopiperazines
Direct Parent
Epipolythiodioxopiperazines
Alternative Parents
Alpha amino acids and derivatives Indoles and derivatives N-methylpiperazines Dithiazinanes Tertiary carboxylic acid amides Pyrrolidines Tertiary amines Secondary alcohols Organic disulfides Lactams Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Epipolythiodioxopiperazine - Indole or derivatives - N-alkylpiperazine - N-methylpiperazine - Dithiazinane - Pyrrolidine - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Lactam - Organic disulfide - Secondary alcohol - Tertiary amine - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Amine - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organooxygen compound - Primary alcohol - Hydrocarbon derivative - Alcohol - Carbonyl group - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as epipolythiodioxopiperazines. These are compounds containing an epipolythiodioxopiperazine moiety, which consists of a 2,3-dithia-5,7-diazabicyclo[2.2.2]octane-6,8-dione ring system. One distinct characteristics of Epipolythiodioxopiperazines is the presence of unique di- or polysulfide bridges.
External Descriptors
Not available