Compound Identification
SMILES
C[C@H](\C=C\CC(=O)N(CCO)CC1=CC=CC=C1)[C@@]1(O)C(=O)N(CC=C)C2=C1C=C(NC(=O)C1CCCNC1)C=C2
InChIKey
InChIKey=ADVSBKYVUCZFGK-JLGXWGSDSA-N
Formula
C32H40N4O5
Mass
560.695
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
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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
Piperidinecarboxamides Indoles and derivatives N-arylamides Benzene and substituted derivatives N-acyl amines Tertiary carboxylic acid amides Tertiary alcohols Secondary carboxylic acid amides Lactams Alkanolamines Azacyclic compounds Dialkylamines Carbonyl compounds Primary alcohols Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta amino acid or derivatives - Indole or derivatives - 3-piperidinecarboxamide - Piperidinecarboxamide - N-arylamide - Benzenoid - Piperidine - Monocyclic benzene moiety - N-acyl-amine - Tertiary carboxylic acid amide - Tertiary alcohol - Secondary carboxylic acid amide - Carboxamide group - Lactam - Organoheterocyclic compound - Azacycle - Secondary amine - Alkanolamine - Secondary aliphatic amine - Alcohol - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Amine - Primary alcohol - Aromatic heteropolycyclic 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