Compound Identification
SMILES
CN(C(CC1=CC=CC=C1)C(=O)NC(CO)CCC(=O)OC(C)(C)C)C(=O)C12CC3OC(=O)C1N(CC1=CC=CC=C1C=CCC1=CC=CC=C1O)OC2C1OCOC31
InChIKey
InChIKey=YHCGFIVBUOYETL-UHFFFAOYSA-N
Formula
C45H53N3O11
Mass
811.929
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
Cinnamylphenols Alpha amino acid esters Gamma amino acids and derivatives Amphetamines and derivatives Styrenes Delta valerolactones Fatty acid esters 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Dicarboxylic acids and derivatives Fatty amides Oxanes 1,3-dioxolanes Tertiary carboxylic acid amides Isoxazolidines Secondary carboxylic acid amides Carboxylic acid esters Oxacyclic compounds Acetals N-organohydroxylamines Azacyclic compounds Organic oxides Organopnictogen compounds Primary alcohols Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylalanine or derivatives - Linear 1,3-diarylpropanoid - Cinnamylphenol - Alpha-amino acid ester - Gamma amino acid or derivatives - Amphetamine or derivatives - Styrene - 1-hydroxy-4-unsubstituted benzenoid - Delta valerolactone - Fatty acid ester - 1-hydroxy-2-unsubstituted benzenoid - Delta_valerolactone - Phenol - Benzenoid - Dicarboxylic acid or derivatives - Fatty amide - Monocyclic benzene moiety - Oxane - Fatty acyl - Isoxazolidine - Meta-dioxolane - Tertiary carboxylic acid amide - Carboxamide group - Lactone - Carboxylic acid ester - Secondary carboxylic acid amide - Azacycle - Acetal - Oxacycle - N-organohydroxylamine - Organoheterocyclic compound - Hydrocarbon derivative - Alcohol - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Primary alcohol - Organic oxygen compound - Organopnictogen compound - Organic oxide - 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