Compound Identification
SMILES
CC(C)(C)OC(=O)CCC(CO)NC(=O)C1CCCN1C(=O)C12CC3OC(=O)C1N(CC1=CC=CC=C1C=COCCO)OC2C1OC(OC31)(C1CC1)C1CC1
InChIKey
InChIKey=JAKSYUIURQEBON-UHFFFAOYSA-N
Formula
C41H55N3O12
Mass
781.9
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 Alpha amino acid esters
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Level 6
Alpha amino acids and derivatives
-
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
Proline and derivatives Alpha amino acid amides Gamma amino acids and derivatives Styrenes Pyrrolidinecarboxamides N-acylpyrrolidines Delta valerolactones Fatty acid esters Ketals Dicarboxylic acids and derivatives Oxanes Isoxazolidines Tertiary carboxylic acid amides 1,3-dioxolanes Secondary carboxylic acid amides Carboxylic acid esters Oxacyclic compounds Azacyclic compounds N-organohydroxylamines Organopnictogen compounds Hydrocarbon derivatives Primary alcohols Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Proline or derivatives - Alpha-amino acid amide - Gamma amino acid or derivatives - N-acylpyrrolidine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Styrene - Delta valerolactone - Ketal - Fatty acid ester - Delta_valerolactone - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Oxane - Fatty acyl - Benzenoid - Tertiary carboxylic acid amide - Pyrrolidine - Meta-dioxolane - Isoxazolidine - Secondary carboxylic acid amide - Lactone - Carboxamide group - Carboxylic acid ester - N-organohydroxylamine - Organoheterocyclic compound - Azacycle - Oxacycle - Acetal - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organooxygen compound - Alcohol - Primary alcohol - Organic nitrogen 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