Compound Identification
SMILES
CCCCCC1(CCCCC)O[C@@H]2C=C(C[C@@H](OC(=O)C3=CC=CC(C=CC(=O)O[C@H]4C(=O)OCC4(C)C)=C3)[C@@H]2O1)C(=O)N(C)[C@H](CC1=CC=CC=C1)C(=O)N[C@H](CO)CCC(=O)OC(C)(C)C
InChIKey
InChIKey=NXMWTZGQPXCJOQ-ZEUGNIPUSA-N
Formula
C53H72N2O13
Mass
945.16
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
Tetracarboxylic acids and derivatives Cinnamic acid esters Gamma amino acids and derivatives Amphetamines and derivatives Benzoic acid esters Styrenes Benzoyl derivatives Ketals Fatty acid esters Gamma butyrolactones Fatty amides Tertiary carboxylic acid amides 1,3-dioxolanes Oxolanes Enoate esters Secondary carboxylic acid amides Oxacyclic compounds Organic oxides Carbonyl compounds Organonitrogen compounds Organopnictogen compounds Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylalanine or derivatives - Tetracarboxylic acid or derivatives - Gamma amino acid or derivatives - Cinnamic acid ester - Cinnamic acid or derivatives - Amphetamine or derivatives - Benzoate ester - Benzoic acid or derivatives - Styrene - Benzoyl - Ketal - Fatty acid ester - Benzenoid - Monocyclic benzene moiety - Gamma butyrolactone - Fatty amide - Fatty acyl - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tertiary carboxylic acid amide - Oxolane - Meta-dioxolane - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Lactone - Organoheterocyclic compound - Acetal - Oxacycle - Alcohol - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - 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