Compound Identification
SMILES
CCCCCC1(CCCCC)OC2C(O1)C1CC3(C2ON(CC2=CC=C(C=CC4CCC5OC5C4)C=C2)C3C(=O)O1)C(=O)NCC1=CC=CC(=C1)C(=O)NCCO
InChIKey
InChIKey=BBJQCXHNRZOHLU-UHFFFAOYSA-N
Formula
C45H59N3O9
Mass
785.979
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 Alpha amino acid esters
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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
Alpha amino acid esters
Alternative Parents
Benzamides Styrenes Benzoyl derivatives N-acylethanolamines Oxepanes Delta valerolactones Ketals Oxanes 1,3-dioxolanes Isoxazolidines Secondary carboxylic acid amides Carboxylic acid esters Epoxides Dialkyl ethers Azacyclic compounds Oxacyclic compounds N-organohydroxylamines Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Organopnictogen compounds Carbonyl compounds Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Benzamide - Benzoic acid or derivatives - N-acylethanolamine - Styrene - Benzoyl - Delta_valerolactone - Oxepane - Ketal - Delta valerolactone - Benzenoid - Oxane - Monocyclic benzene moiety - Meta-dioxolane - Isoxazolidine - Secondary carboxylic acid amide - Lactone - Carboxylic acid ester - Carboxamide group - Acetal - Alkanolamine - Oxacycle - Azacycle - N-organohydroxylamine - Organoheterocyclic compound - Dialkyl ether - Oxirane - Ether - Monocarboxylic acid or derivatives - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organonitrogen compound - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available