Compound Identification
SMILES
COC(=O)C(CC1=CC=CC=C1)NC(=O)NCC1=CC=CC(=C1)C1=CC=C(C=C1)C1OC(CSC2=NC3=CC=CC=C3S2)CC(O1)C1=CC=C(CO)C=C1
InChIKey
InChIKey=CDXWOTAKGVYDIG-UHFFFAOYSA-N
Formula
C43H41N3O6S2
Mass
759.94
Taxonomic Classification
Taxonomy Tree
-
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
-
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 N-carbamoyl-alpha amino acids Biphenyls and derivatives Amphetamines and derivatives Benzothiazoles Benzyl alcohols Alkylarylthioethers Fatty acid esters 1,3-dioxanes Thiazoles Methyl esters Heteroaromatic compounds Ureas Sulfenyl compounds Acetals Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Primary alcohols Aromatic alcohols Organonitrogen compounds Organic oxides Organopnictogen compounds Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylalanine or derivatives - Alpha-amino acid ester - N-carbamoyl-alpha-amino acid - N-carbamoyl-alpha-amino acid or derivatives - Biphenyl - Amphetamine or derivatives - 1,3-benzothiazole - Aryl thioether - Benzyl alcohol - Fatty acid ester - Alkylarylthioether - Meta-dioxane - Monocyclic benzene moiety - Benzenoid - Fatty acyl - Methyl ester - Azole - Heteroaromatic compound - Thiazole - Urea - Carbonic acid derivative - Carboxylic acid ester - Organoheterocyclic compound - Sulfenyl compound - Thioether - Acetal - Azacycle - Oxacycle - Monocarboxylic acid or derivatives - Primary alcohol - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Aromatic 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