Compound Identification
SMILES
OCCNC(=O)C1CCCN1C(=O)C12CC3OC(=O)C1N(CC1=CC=C(C=COCCO)C=C1)OC2C1OC2(CC4=CC=CC=C4C2)OC31
InChIKey
InChIKey=MNKOPJZPHZVFFE-UHFFFAOYSA-N
Formula
C36H41N3O10
Mass
675.735
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
-
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
Proline and derivatives Alpha amino acid amides Indanes Styrenes Pyrrolidinecarboxamides N-acylethanolamines N-acylpyrrolidines Delta valerolactones Ketals Oxanes Tertiary carboxylic acid amides Isoxazolidines 1,3-dioxolanes Secondary carboxylic acid amides Carboxylic acid esters Monocarboxylic acids and derivatives Oxacyclic compounds Azacyclic compounds N-organohydroxylamines Hydrocarbon derivatives Carbonyl compounds Organic oxides Organopnictogen compounds Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Proline or derivatives - Alpha-amino acid amide - Indane - N-acylpyrrolidine - N-acylethanolamine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Styrene - Ketal - Delta_valerolactone - Delta valerolactone - Monocyclic benzene moiety - Oxane - Benzenoid - Pyrrolidine - Isoxazolidine - Meta-dioxolane - Tertiary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Lactone - Acetal - Alkanolamine - Oxacycle - Azacycle - N-organohydroxylamine - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Alcohol - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Primary alcohol - Organooxygen compound - Organonitrogen 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