Compound Identification
SMILES
COC(=O)C[C@H]1C[C@@H]2N(C[C@@H]1[C@@H](C)O)[C@H](CC1=C2NC2=CC=CC=C12)C(=O)OCC1=CC=CC=C1
InChIKey
InChIKey=ZZADTWJWTRBTKA-JXCCLVJISA-N
Formula
C28H32N2O5
Mass
476.573
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
-
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 Quinolizines Benzyloxycarbonyls Aralkylamines Piperidines Dicarboxylic acids and derivatives 1,3-aminoalcohols Pyrroles Methyl esters Heteroaromatic compounds Secondary alcohols Trialkylamines Azacyclic compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Beta-carboline - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Quinolizine - 3-alkylindole - Indole - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Piperidine - 1,3-aminoalcohol - Methyl ester - Pyrrole - Heteroaromatic compound - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Secondary alcohol - Azacycle - Carboxylic acid derivative - Organic oxide - Organic oxygen compound - Alcohol - Carbonyl group - Organonitrogen compound - Amine - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - 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