Compound Identification
SMILES
CCCCCC1(CCCCC)O[C@H]2[C@@H](O1)[C@H]1C[C@@]3([C@@H]2ON(CC2=CC=C(C=COCCO)C=C2)[C@@H]3C(=O)O1)C(=O)NCCC(=O)NCCO
InChIKey
InChIKey=VFBIIOQFYYQVJS-HENIYYNKSA-N
Formula
C36H53N3O10
Mass
687.831
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
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
-
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
Alpha amino acid esters
Alternative Parents
Beta amino acids and derivatives Styrenes N-acylethanolamines Delta valerolactones Ketals Oxanes 1,3-dioxolanes Isoxazolidines Secondary carboxylic acid amides Carboxylic acid esters Azacyclic compounds Oxacyclic compounds N-organohydroxylamines Monocarboxylic acids and derivatives Organopnictogen compounds Organic oxides Hydrocarbon derivatives Primary alcohols Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Beta amino acid or derivatives - N-acylethanolamine - Styrene - Ketal - Delta_valerolactone - Delta valerolactone - Monocyclic benzene moiety - Benzenoid - Oxane - Isoxazolidine - Meta-dioxolane - Lactone - Carboxylic acid ester - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - N-organohydroxylamine - Monocarboxylic acid or derivatives - Azacycle - Oxacycle - Acetal - Alkanolamine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Primary alcohol - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Alcohol - Organic oxygen compound - 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