Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(C=C1)S(O)(=O)=O.CC1=CC=C(C=C1)S(O)(=O)=O.COC1=CC2=NC=CC(OC3=CN=C(NC(=O)C4=C(C)N(C[C@@H](C)OC(=O)[C@H](C)N)N(C4=O)C4=CC=CC=C4)C=C3)=C2C=C1

InChIKey

InChIKey=BNHUDXHXDSSQNA-AAYDIPMQSA-N

Formula

C46H48N6O12S2

Mass

941.04

Export to:

JSON SDF CSV

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 - Alpha amino acids and derivatives

Direct Parent

Alpha amino acid esters

Alternative Parents

Molecular Framework

Not available

Substituents

Alpha-amino acid ester - Alanine or derivatives - Diaryl ether - Phenylpyrazole - P-methylbenzenesulfonate - Quinoline - Benzenesulfonate - Tosyl compound - Benzenesulfonyl group - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Anisole - Pyrazole-4-carboxamide - Phenol ether - Alkyl aryl ether - Toluene - Monocyclic benzene moiety - Pyrazolinone - Pyridine - Imidolactam - Benzenoid - Organic sulfonic acid or derivatives - Vinylogous amide - Sulfonyl - Organosulfonic acid - Pyrazole - Organosulfonic acid or derivatives - Azole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactam - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Ether - Organic oxide - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Hydrocarbon derivative - Primary amine - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.

External Descriptors

Not available

Previous Back Next