Compound Identification
SMILES
COC(=O)C1CC2=C(CN1C(=O)CSC1=NN=C(O1)C(CCSC)NC(=O)OC(C)(C)C)NC1=CC=CC=C21
InChIKey
InChIKey=KICQTYUUJNIMIU-UHFFFAOYSA-N
Formula
C26H33N5O6S2
Mass
575.7
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
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Subclass
Pyridoindoles
- Level 5 Beta carbolines
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Subclass
Pyridoindoles
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Class
Indoles and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Pyridoindoles
Intermediate Tree Nodes
Not available
Direct Parent
Beta carbolines
Alternative Parents
Alpha amino acid esters 3-alkylindoles Alkylarylthioethers Benzenoids Tertiary carboxylic acid amides 1,3,4-oxadiazoles Pyrroles Methyl esters Carbamate esters Heteroaromatic compounds Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Dialkylthioethers Organic oxides Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Beta-carboline - Alpha-amino acid or derivatives - 3-alkylindole - Indole - Aryl thioether - Alkylarylthioether - Benzenoid - 1,3,4-oxadiazole - Azole - Oxadiazole - Pyrrole - Tertiary carboxylic acid amide - Carbamic acid ester - Methyl ester - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - Azacycle - Dialkylthioether - Oxacycle - Sulfenyl compound - Thioether - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Organooxygen compound - Carbonyl group - Organosulfur compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as beta carbolines. These are compounds containing a 9H-pyrido[3,4-b]indole moiety.
External Descriptors
Not available