Compound Identification
SMILES
OC[C@H]1O[C@H](OC2=CC=CC=C2C2=CC=C(C=C2)C(=O)N[C@H](CC2=CC=CC=C2)C(O)=O)[C@@H](O)[C@@H](O)[C@@H]1O
InChIKey
InChIKey=BFIQZSLRJQAAJO-FAPXZCDMSA-N
Formula
C28H29NO9
Mass
523.538
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
-
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
Phenolic glycosides Hippuric acids N-acyl-alpha amino acids Biphenyls and derivatives Hexoses Phenylpropanoic acids O-glycosyl compounds Amphetamines and derivatives Phenoxy compounds Phenol ethers Benzoyl derivatives Oxanes Secondary carboxylic acid amides Secondary alcohols Polyols Oxacyclic compounds Acetals Carboxylic acids Monocarboxylic acids and derivatives Primary alcohols Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylalanine or derivatives - Phenolic glycoside - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - Hippuric acid - Hippuric acid or derivatives - Hexose monosaccharide - Biphenyl - 3-phenylpropanoic-acid - O-glycosyl compound - Glycosyl compound - Amphetamine or derivatives - Benzamide - Benzoic acid or derivatives - Phenoxy compound - Benzoyl - Phenol ether - Monocyclic benzene moiety - Benzenoid - Monosaccharide - Oxane - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Monocarboxylic acid or derivatives - Polyol - Acetal - Organoheterocyclic compound - Oxacycle - Carboxylic acid - Primary alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Alcohol - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Organonitrogen compound - 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