Compound Identification
SMILES
C=C.CCN(C1CC(C)(C)NC(C)(C)C1)C1=NC(=NC(NCC(=O)OCCOC(=O)CNC2=NC(=NC(=N2)N(CC)C2CC(C)(C)NC(C)(C)C2)N(CC)C2CC(C)(C)NC(C)(C)C2)=N1)N(CC)C1CC(C)(C)NC(C)(C)C1
InChIKey
InChIKey=VBFPCMCBVQNTTM-UHFFFAOYSA-N
Formula
C58H106N16O4
Mass
1091.594
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
Dialkylarylamines N-aliphatic s-triazines Piperidines Dicarboxylic acids and derivatives 1,3,5-triazines Heteroaromatic compounds Carboxylic acid esters Dialkylamines Azacyclic compounds Unsaturated aliphatic hydrocarbons Organopnictogen compounds Organic oxides Olefins Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Alpha-amino acid ester - Dialkylarylamine - Amino-1,3,5-triazine - Aminotriazine - N-aliphatic s-triazine - Dicarboxylic acid or derivatives - Piperidine - Triazine - 1,3,5-triazine - Heteroaromatic compound - Carboxylic acid ester - Secondary aliphatic amine - Secondary amine - Azacycle - Organoheterocyclic compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Olefin - Unsaturated hydrocarbon - Organic nitrogen compound - Unsaturated aliphatic hydrocarbon - Carbonyl group - Amine - Hydrocarbon derivative - Organic oxygen compound - Organopnictogen compound - Hydrocarbon - Aromatic heteromonocyclic 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