Compound Identification
SMILES
OC(=O)C(F)(F)F.O=C(NCc1ccco1)[C@@H]1CC[C@@H]2[C@@H](CCN2CC2CC2)O1
InChIKey
InChIKey=QOPUBFANENWSCJ-IFKKJYDISA-N
Formula
C19H25F3N2O5
Mass
418.413
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
- Level 5 Sugar acids and derivatives
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbohydrates and carbohydrate conjugates
Intermediate Tree Nodes
Sugar acids and derivatives - Sugar amino acids and derivatives
Direct Parent
Pyranoid amino acids and derivatives
Alternative Parents
Pyrans Oxanes N-alkylpyrrolidines Alpha-halocarboxylic acids Furans Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Carboxylic acids Dialkyl ethers Monocarboxylic acids and derivatives Organopnictogen compounds Alkyl fluorides Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Pyranoid amino acid - Oxane - Pyran - N-alkylpyrrolidine - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Furan - Heteroaromatic compound - Pyrrolidine - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Dialkyl ether - Ether - Amine - Organic oxide - Organohalogen compound - Organofluoride - Alkyl halide - Carbonyl group - Alkyl fluoride - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyranoid amino acids and derivatives. These are compounds containing a (hydro)pyran ring bearing unprotected amino and carboxylic acid functionalities.
External Descriptors
Not available