Compound Identification
SMILES
CN(C(CC1=CC=CC=C1)C(=O)NCCO)C(=O)C12CC3OC(=O)C1N(CC1=CC=C(C=COCCO)C=C1)OC2C1OCOC31
InChIKey
InChIKey=TXEXZLPQFSWPQQ-UHFFFAOYSA-N
Formula
C33H39N3O10
Mass
637.686
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
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
-
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 Amphetamines and derivatives Styrenes N-acylethanolamines Delta valerolactones Oxanes Fatty amides Tertiary carboxylic acid amides 1,3-dioxolanes Isoxazolidines Secondary carboxylic acid amides Carboxylic acid esters Acetals Oxacyclic compounds Azacyclic compounds N-organohydroxylamines Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Organopnictogen compounds Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylalanine or derivatives - Alpha-amino acid ester - Amphetamine or derivatives - N-acylethanolamine - Styrene - Delta valerolactone - Delta_valerolactone - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Benzenoid - Oxane - Meta-dioxolane - Isoxazolidine - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactone - Secondary carboxylic acid amide - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Alkanolamine - N-organohydroxylamine - Azacycle - Oxacycle - Acetal - Primary alcohol - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Alcohol - 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