Structure Information
Structure

Compound Identification

SMILES

Cl.Cl.Cl.CN(C)CCNC1=C2C(=O)C3=C(C=NC=C3)C(=O)C2=C(NCCCN(C)CCCNC2=C3C(=O)C4=C(C=CN=C4)C(=O)C3=C(NCCN(C)C)C=C2)C=C1

InChIKey

InChIKey=VTSAWUNWVUWSJK-UHFFFAOYSA-N

Formula

C41H52Cl3N9O4

Mass

841.28

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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

Aromatic heteropolycyclic compounds

Substituents

Isoquinoline quinone - Naphthalene - Pyridine carboxylic acid or derivatives - Aryl ketone - Secondary aliphatic/aromatic amine - Pyridine - Benzenoid - Heteroaromatic compound - Vinylogous amide - Ketone - Tertiary aliphatic amine - Tertiary amine - Azacycle - Secondary amine - Amine - Hydrochloride - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic 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

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