Compound Identification
SMILES
COC(=O)C(CNCC1=CC=CC=C1)C(OC1CCCCO1)C1=CC=CC=C1
InChIKey
InChIKey=CACSNTXHLXSQGQ-UHFFFAOYSA-N
Formula
C23H29NO4
Mass
383.488
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 Beta 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
Direct Parent
Beta amino acids and derivatives
Alternative Parents
Phenylmethylamines Benzylamines Fatty acid esters Aralkylamines Oxanes Methyl esters Oxacyclic compounds Monocarboxylic acids and derivatives Dialkylamines Acetals Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Beta amino acid or derivatives - Benzylamine - Phenylmethylamine - Fatty acid ester - Aralkylamine - Monocyclic benzene moiety - Oxane - Benzenoid - Fatty acyl - Methyl ester - Carboxylic acid ester - Oxacycle - Secondary amine - Acetal - Organoheterocyclic compound - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Aromatic 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