Compound Identification
SMILES
COC(=O)[C@]1(C)NC2=C(O)C=C3N(CC(CCl)C3=C2C1=O)C(=O)C1=CC2=CC(OC)=C(OC)C(OC)=C2N1
InChIKey
InChIKey=BOGFADYROAVVTF-HYOGVKGJSA-N
Formula
C26H26ClN3O8
Mass
543.96
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid esters
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Alpha amino acid esters
Alternative Parents
Indolecarboxamides and derivatives Indolecarboxylic acids Pyrroloindoles Indoles Indolines 2-heteroaryl carboxamides Anisoles Aryl alkyl ketones Pyrrole carboxamides Secondary alkylarylamines Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Substituted pyrroles Methyl esters Tertiary carboxylic acid amides Vinylogous amides Heteroaromatic compounds Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organopnictogen compounds Alkyl chlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Indolecarboxamide derivative - Indolecarboxylic acid - Indolecarboxylic acid derivative - Pyrroloindole - Indole - Indole or derivatives - Dihydroindole - 2-heteroaryl carboxamide - Anisole - Phenol ether - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Aryl ketone - Aryl alkyl ketone - Secondary aliphatic/aromatic amine - Alkyl aryl ether - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Substituted pyrrole - Benzenoid - Tertiary carboxylic acid amide - Vinylogous amide - Heteroaromatic compound - Pyrrole - Methyl ester - Carboxamide group - Carboxylic acid ester - Ketone - Monocarboxylic acid or derivatives - Secondary amine - Azacycle - Organoheterocyclic compound - Ether - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Alkyl halide - Amine - Alkyl chloride - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available