Compound Identification
SMILES
COC1=CC=C(CCNC(=O)\C=N\N2CC(=O)N3CC4=C(C[C@H]3C2=O)C2=CC=CC=C2N4)C=C1
InChIKey
InChIKey=YBHRZTOJJKFLEW-IQFHQVDXSA-N
Formula
C25H25N5O4
Mass
459.506
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
3-alkylindoles Alpha amino acids and derivatives 2,5-dioxopiperazines Phenoxy compounds Methoxybenzenes Anisoles N-alkylpiperazines Alkyl aryl ethers Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Secondary carboxylic acid amides N-alkylated hydrazones Lactams Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta-carboline - Alpha-amino acid or derivatives - 3-alkylindole - Indole - Phenoxy compound - Anisole - Dioxopiperazine - Methoxybenzene - 2,5-dioxopiperazine - Phenol ether - Alkyl aryl ether - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Benzenoid - Piperazine - Tertiary carboxylic acid amide - Pyrrole - Heteroaromatic compound - N-alkylated hydrazone - Secondary carboxylic acid amide - Lactam - Carboxamide group - Azacycle - Ether - Carboxylic acid derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen 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