Compound Identification
SMILES
COC(=O)C1=C(C)C(C(=O)OC)=C(NC(=O)CCN2CCCN(CC2)C(=O)C2=CC=CC=C2)S1
InChIKey
InChIKey=SZTKTROANCEPME-UHFFFAOYSA-N
Formula
C24H29N3O6S
Mass
487.57
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
-
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
Benzamides Thiophene carboxylic acids and derivatives N-arylamides Benzoyl derivatives 1,4-diazepanes Vinylogous amides Tertiary carboxylic acid amides Methyl esters Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Beta amino acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Thiophene carboxylic acid or derivatives - N-arylamide - 1,4-diazepane - Diazepane - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Methyl ester - Thiophene - Heteroaromatic compound - Tertiary carboxylic acid amide - Tertiary aliphatic amine - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Tertiary amine - Organoheterocyclic compound - Azacycle - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen 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