Structure Information
Structure

Compound Identification

SMILES

CC1=CN([C@H]2C[C@H](N=[N+]=[N-])[C@@H](COP(=O)(OCC3=CC=C(O)C=C3)OCC3=CC=C(C=C3)C(=O)OC(C)(C)C)O2)C(=O)NC1=O

InChIKey

InChIKey=ZPACZVOIRLRRGD-KZWKSOEZSA-N

Formula

C29H34N5O10P

Mass

643.59

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Benzoic acid esters

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzoate ester - Benzoyl - Trialkyl phosphate - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Pyrimidone - Hydropyrimidine - Organic phosphoric acid derivative - Phosphoric acid ester - Pyrimidine - Alkyl phosphate - Heteroaromatic compound - Oxolane - Vinylogous amide - Azo compound - Azo imide - Carboxylic acid ester - Lactam - Urea - Oxacycle - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic salt - Organic zwitterion - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

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

External Descriptors

Not available

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