Structure Information
Structure

Compound Identification

SMILES

CO[C@@H]1[C@H]2[C@H](O)N3[C@@H](CC4=C([C@@H]3COC(=O)C(\C)=C/C)C(=O)C(OC)=C(C)C4=O)C(N2C)C2=C1C(=O)C(C)=C(OC)C2=O

InChIKey

InChIKey=VOTUDDUJVIHMMZ-BNQCNWFPSA-N

Formula

C31H36N2O10

Mass

596.633

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Isoquinolines and derivatives

Subclass

Isoquinoline quinones

Intermediate Tree Nodes

Not available

Direct Parent

Isoquinoline quinones

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Isoquinoline quinone - Isoquinolone - Fatty acid ester - N-methylpiperazine - N-alkylpiperazine - 1,4-diazinane - Piperazine - Fatty acyl - Vinylogous ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Hemiaminal - Ketone - Alkanolamine - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Carbonyl group - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organopnictogen compound - Organic oxide - Organonitrogen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoquinoline quinones. These are isoquinoline derivative with a structure containing a 5,8-dihydroisoquinoline-5,8-dione skeleton.

External Descriptors

Not available

Previous Back Next