Structure Information
Structure

Compound Identification

SMILES

CO[C@]12C3NC3CN1C1=C(C2COC(N)=O)C(=O)C(NCCC2=CN=CN2)=C(C)C1=O

InChIKey

InChIKey=PRQNNWWXCIPTRY-FUVXEMBBSA-N

Formula

C20H24N6O5

Mass

428.449

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Indolequinones

Intermediate Tree Nodes

Mitomycins, mitosane and mitosene derivatives

Direct Parent

Mitomycins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Mitomycin - Indole - Pyrrolizine - Quinone - Aralkylamine - 1,4-diazinane - Piperazine - Azole - Imidazole - Pyrrolidine - Pyrroline - Heteroaromatic compound - Carbamic acid ester - Vinylogous amide - Ketone - Tertiary amine - Aziridine - Enamine - Azacycle - Secondary amine - Secondary aliphatic amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as mitomycins. These are polycyclic compounds with a structure based on an aziridine ring linked to a 7-amino-6-methyl-cyclohexa[b]pyrrolizine-5,8-dione.

External Descriptors

Not available

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