Structure Information
Structure

Compound Identification

SMILES

CO[C@@H](C[C@H](C)CC1=C(NCCCCNC2=C(C[C@@H](C)C[C@H](OC)[C@H](O)[C@@H](C)\C=C(/C)[C@H](OC(N)=O)[C@@H](OC)\C=C\C=C(/C)C(=O)OC)C(=O)C(N)=CC2=O)C(=O)C=C(N)C1=O)[C@H](O)[C@@H](C)\C=C(/C)[C@H](OC(N)=O)[C@@H](OC)\C=C\C=C(/C)C(=O)OC

InChIKey

InChIKey=YLLSJQGMDLEOIP-VZLIOORUSA-N

Formula

C62H92N6O18

Mass

1209.442

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones - Quinones - Benzoquinones

Direct Parent

P-benzoquinones

Alternative Parents

Fatty acid esters Dicarboxylic acids and derivatives Vinylogous amides Methyl esters Enoate esters Carbamate esters Secondary alcohols Enamines Dialkylamines Dialkyl ethers Organic oxides Monoalkylamines Hydrocarbon derivatives

Molecular Framework

Aliphatic homomonocyclic compounds

Substituents

P-benzoquinone - Fatty acid ester - Dicarboxylic acid or derivatives - Fatty acyl - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Carbamic acid ester - Amino acid or derivatives - Carboxylic acid ester - Secondary alcohol - Carboxylic acid derivative - Dialkyl ether - Secondary aliphatic amine - Enamine - Ether - Secondary amine - Hydrocarbon derivative - Amine - Organic nitrogen compound - Alcohol - Organic oxide - Primary aliphatic amine - Organonitrogen compound - Primary amine - Aliphatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as p-benzoquinones. These are benzoquinones where the two C=O groups are attached at the 1- and 4-positions, respectively.

External Descriptors

Not available

Previous Back Next