Compound Identification
SMILES
CC1CC(=O)\C(C(=O)O1)=C1/NC2=C(C3=C(N2)C=C(O)C=C3)C(=C1)C(=O)OC[C@@H](O)CO
InChIKey
InChIKey=FHZQQMQSERBHIA-KOXPVJFSSA-N
Formula
C21H20N2O8
Mass
428.397
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 Alpha 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
Alpha carbolines
Alternative Parents
Hydroxyindoles Indoles 1-monoacylglycerols 1-hydroxy-2-unsubstituted benzenoids Delta valerolactones Dicarboxylic acids and derivatives Oxanes Vinylogous amides Heteroaromatic compounds Enoate esters Pyrroles 1,2-diols Cyclic ketones Secondary alcohols Enamines Azacyclic compounds Oxacyclic compounds Primary alcohols Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-carboline - Hydroxyindole - Indole - 1-acyl-sn-glycerol - Monoacylglycerol - Monoradylglycerol - 1-hydroxy-2-unsubstituted benzenoid - Delta valerolactone - Delta_valerolactone - Phenol - Glycerolipid - Dicarboxylic acid or derivatives - Oxane - Benzenoid - Vinylogous amide - Pyrrole - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Heteroaromatic compound - Cyclic ketone - Secondary alcohol - Carboxylic acid ester - Lactone - Ketone - 1,2-diol - Azacycle - Carboxylic acid derivative - Oxacycle - Enamine - Alcohol - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Amine - Organic oxygen compound - Organic nitrogen compound - Primary alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha carbolines. These are organic compounds containing a pyrido[2,3-b]indole core (which is a pyridine fused to an indole).
External Descriptors
Not available