Compound Identification
SMILES
CC1=CC=C(NC(=O)COC(=O)C(CC2=CC=CC=C2)N2C(=O)C3=C(C=C(C=C3)C(=O)OCC(=O)NC3=CC=C(C)C=C3)C2=O)C=C1
InChIKey
InChIKey=XKEACFUCLQDITN-UHFFFAOYSA-N
Formula
C36H31N3O8
Mass
633.657
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 Phenylalanine and derivatives
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
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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
Phenylalanine and derivatives
Alternative Parents
Alpha amino acid esters Phthalimides Amphetamines and derivatives Isoindoles Anilides N-arylamides Toluenes Fatty acid esters N-substituted carboxylic acid imides Dicarboxylic acids and derivatives Secondary carboxylic acid amides Carboxylic acid esters Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylalanine or derivatives - Alpha-amino acid ester - Phthalimide - Amphetamine or derivatives - Isoindolone - Isoindole - Isoindole or derivatives - Isoindoline - Anilide - N-arylamide - Fatty acid ester - Toluene - Fatty acyl - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Benzenoid - Dicarboxylic acid or derivatives - Carboxylic acid imide - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available