Compound Identification
SMILES
CCCCCC1(CCCCC)O[C@H]2[C@@H](O1)[C@H]1C[C@@]3([C@@H]2ON(CC2=CC=CC(C=CC4CCC5OC5C4)=C2)[C@@H]3C(=O)O1)C(=O)N(C)[C@H](CC1=CC=CC=C1)C(=O)NCCO
InChIKey
InChIKey=ULKVBGHNCNKRGI-VPPZRCOOSA-N
Formula
C47H63N3O9
Mass
814.033
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
Alpha amino acid esters Amphetamines and derivatives Styrenes N-acylethanolamines Delta valerolactones Ketals Oxepanes Oxanes Fatty amides 1,3-dioxolanes Tertiary carboxylic acid amides Isoxazolidines Secondary carboxylic acid amides Carboxylic acid esters Oxacyclic compounds Azacyclic compounds N-organohydroxylamines Dialkyl ethers Epoxides Monocarboxylic acids and derivatives Primary alcohols Organic oxides Carbonyl compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylalanine or derivatives - Alpha-amino acid ester - Amphetamine or derivatives - Styrene - N-acylethanolamine - Oxepane - Ketal - Delta valerolactone - Delta_valerolactone - Oxane - Monocyclic benzene moiety - Benzenoid - Fatty acyl - Fatty amide - Tertiary carboxylic acid amide - Meta-dioxolane - Isoxazolidine - Carboxamide group - Carboxylic acid ester - Lactone - Secondary carboxylic acid amide - Alkanolamine - Acetal - Dialkyl ether - Oxirane - Ether - Oxacycle - Azacycle - N-organohydroxylamine - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Primary alcohol - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Alcohol - Carbonyl group - Organic nitrogen 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