Compound Identification
SMILES
CN[C@H]1[C@@H](O)[C@H](O[C@H]2OC(CN)=CC[C@H]2NC(=O)C[C@@H](N)CCCN)[C@@H](N)[C@H](O)[C@H]1OC
InChIKey
InChIKey=WTENXKAJCSHCNH-QJSCRMMJSA-N
Formula
C20H40N6O6
Mass
460.576
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
- Level 6 Beta amino acids and derivatives
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Level 5
Amino acids and derivatives
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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
Direct Parent
Beta amino acids and derivatives
Alternative Parents
Aminocyclitols and derivatives Cyclohexylamines Cyclohexanols N-acyl amines Secondary carboxylic acid amides 1,2-aminoalcohols Oxacyclic compounds Dialkylamines Dialkyl ethers Acetals Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Beta amino acid or derivatives - Aminocyclitol or derivatives - Cyclohexylamine - Cyclohexanol - Fatty acyl - N-acyl-amine - Fatty amide - Cyclitol or derivatives - Cyclic alcohol - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - 1,2-aminoalcohol - Oxacycle - Organoheterocyclic compound - Secondary amine - Ether - Secondary aliphatic amine - Dialkyl ether - Acetal - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Carbonyl group - Amine - Alcohol - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
External Descriptors
Not available