Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)S(=O)(=O)C[C@H](CC1=CC=CC2=CC=CC=C12)C(=O)NCCC(=O)N[C@@H](CC1=CC=CC=C1)[C@@H](O)[C@H](O)[C@H](CC1=CC=CC=C1)NC(=O)CCNC(=O)[C@@H](CC1=CC=CC2=CC=CC=C12)CS(=O)(=O)C(C)(C)C

InChIKey

InChIKey=DIHVPPHPVOCACO-VWCKXYCISA-N

Formula

C60H74N4O10S2

Mass

1075.39

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Beta amino acid or derivatives - Amphetamine or derivatives - Naphthalene - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Fatty amide - Sulfonyl - Sulfone - 1,2-diol - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Alcohol - Aromatic homopolycyclic 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

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