Compound Identification
SMILES
COOOSC1=CC=CC=C1\C=N\[NH2+]C1=NC=C(C=C1)C(=O)NCCCOC1=CC=C(CC(NC(=O)CCCCCOC2=CC(=CC(=N2)C2=CC=CC=C2)C2=CC3=C(OCO3)C=C2)C(O)=O)C=C1
InChIKey
InChIKey=JMQFCXHLZXPYLR-SAPJFSEZSA-O
Formula
C50H51N6O11S
Mass
944.05
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
N-acyl-alpha amino acids Phenylpyridines Phenylpropanoic acids Amphetamines and derivatives Benzodioxoles Nicotinamides Phenoxy compounds Phenol ethers Alkyl aryl ethers N-acyl amines Heteroaromatic compounds Secondary carboxylic acid amides Acetals Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Sulfenyl compounds Oxacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylalanine or derivatives - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - 2-phenylpyridine - 4-phenylpyridine - 3-phenylpropanoic-acid - Amphetamine or derivatives - Benzodioxole - Nicotinamide - Pyridine carboxylic acid or derivatives - Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Fatty amide - N-acyl-amine - Fatty acyl - Benzenoid - Pyridine - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Sulfenyl compound - Acetal - Organoheterocyclic compound - Azacycle - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Oxacycle - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic cation - 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