Compound Identification
SMILES
COC1=C(OC)C=C2C(NC3=C2CCN2[C@H]3C[C@H]3[C@@H](C=C)[C@H](O[C@@H]4O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]4OC(C)=O)OC=C3C2=O)=C1
InChIKey
InChIKey=BTMHCTDJAMRQCV-NHLJGOTMSA-N
Formula
C36H42N2O14
Mass
726.732
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
Tetracarboxylic acids and derivatives O-glycosyl compounds 3-alkylindoles Anisoles Alkyl aryl ethers Piperidinones Delta lactams Oxanes Monosaccharides Heteroaromatic compounds Vinylogous esters Pyrroles Tertiary carboxylic acid amides Carboxylic acid esters Oxacyclic compounds Acetals Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta-carboline - Tetracarboxylic acid or derivatives - Glycosyl compound - O-glycosyl compound - 3-alkylindole - Indole - Anisole - Alkyl aryl ether - Delta-lactam - Piperidinone - Monosaccharide - Oxane - Benzenoid - Piperidine - Pyrrole - Tertiary carboxylic acid amide - Vinylogous ester - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - Lactam - Oxacycle - Ether - Carboxylic acid derivative - Acetal - Azacycle - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Organooxygen compound - Organonitrogen 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