Compound Identification
SMILES
COC(=O)C1(C)NC2=C(OC)C=C3N(CC(CBr)C3=C2C1=O)C(=O)C1=CC2=CC(OC)=C(OC)C(OC)=C2N1
InChIKey
InChIKey=WMWSADASWWULMW-UHFFFAOYSA-N
Formula
C27H28BrN3O8
Mass
602.438
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
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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 Substituted pyrroles Methyl esters Tertiary carboxylic acid amides Vinylogous amides Heteroaromatic compounds Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Alkyl bromides Organic oxides Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Pyrroloindole - Indolecarboxylic acid derivative - Indolecarboxylic acid - Indolecarboxamide derivative - Dihydroindole - Indole or derivatives - Indole - 2-heteroaryl carboxamide - Aryl alkyl ketone - Aryl ketone - Phenol ether - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Anisole - Secondary aliphatic/aromatic amine - Alkyl aryl ether - Benzenoid - Substituted pyrrole - Tertiary carboxylic acid amide - Methyl ester - Pyrrole - Heteroaromatic compound - Vinylogous amide - Carboxamide group - Carboxylic acid ester - Ketone - Secondary amine - Ether - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Alkyl bromide - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organonitrogen compound - Carbonyl group - Organic oxide - Amine - Organic oxygen compound - Alkyl halide - Organooxygen compound - 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