Compound Identification
SMILES
COC1=CC=CC=C1SCC1CC(OC(O1)C1=CC(NC(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C2=CC=C(C)C=C2)=CC=C1)C1=CC=C(CO)C=C1
InChIKey
InChIKey=XYKCLIPFNMVGAY-UHFFFAOYSA-N
Formula
C41H42N2O7S2
Mass
738.91
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
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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 amides P-toluenesulfonamides Amphetamines and derivatives Benzenesulfonamides Anilides Benzenesulfonyl compounds Thiophenol ethers Phenoxy compounds Anisoles N-arylamides Methoxybenzenes Benzyl alcohols Alkyl aryl ethers Alkylarylthioethers 1,3-dioxanes Organosulfonamides Fatty amides Aminosulfonyl compounds Secondary carboxylic acid amides Acetals Oxacyclic compounds Sulfenyl compounds Organic oxides Aromatic alcohols Organopnictogen compounds Primary alcohols Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylalanine or derivatives - Alpha-amino acid amide - P-toluenesulfonamide - Tosyl compound - Benzenesulfonamide - Amphetamine or derivatives - Anilide - Benzenesulfonyl group - Aryl thioether - Phenoxy compound - Phenol ether - Thiophenol ether - Benzyl alcohol - N-arylamide - Methoxybenzene - Anisole - Toluene - Alkyl aryl ether - Alkylarylthioether - Benzenoid - Fatty acyl - Organosulfonic acid amide - Monocyclic benzene moiety - Fatty amide - Meta-dioxane - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Organosulfonic acid or derivatives - Sulfonyl - Carboxamide group - Secondary carboxylic acid amide - Acetal - Oxacycle - Organoheterocyclic compound - Sulfenyl compound - Ether - Thioether - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Alcohol - Primary alcohol - Hydrocarbon derivative - Organopnictogen compound - Aromatic alcohol - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Aromatic heteromonocyclic 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