Compound Identification
SMILES
COC1=C(NC(=O)N(C)C2=CC=CC=C2C)C=CC(CC(=O)N(C)C2=CC=C(C=C2)C(CC(O)=O)NC(=O)C2=NOC(C)=C2)=C1
InChIKey
InChIKey=GKHXJAOSZQKAJK-UHFFFAOYSA-N
Formula
C33H35N5O7
Mass
613.671
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 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
Phenylpropanoic acids Phenylacetamides N-phenylureas Anilides Methoxyanilines Phenoxy compounds 2-heteroaryl carboxamides Anisoles Methoxybenzenes Toluenes Alkyl aryl ethers Tertiary carboxylic acid amides Isoxazoles Heteroaromatic compounds Ureas Secondary carboxylic acid amides Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Organic oxides Carbonyl compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-phenylpropanoic-acid - Beta amino acid or derivatives - N-phenylurea - Phenylacetamide - Anilide - Methoxyaniline - 2-heteroaryl carboxamide - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Toluene - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Azole - Tertiary carboxylic acid amide - Isoxazole - Urea - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - 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