Structure Information
Structure

Compound Identification

SMILES

CO[C@]12[C@H]3N[C@H]3CN1C1=C([C@H]2COC(N)=O)C(=O)C(N)=C(C=NC2=C(C)N(C)N(C2=O)C2=CC=CC=C2)C1=O

InChIKey

InChIKey=DXERLMIYYSELDT-WSSSWDRZSA-N

Formula

C26H27N7O6

Mass

533.545

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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 - Phenylpyrazole - Indole - Pyrrolizine - Quinone - 1,4-diazinane - Piperazine - Pyrazolinone - Monocyclic benzene moiety - Benzenoid - Carbamic acid ester - Vinylogous amide - Heteroaromatic compound - Pyrroline - Pyrrolidine - Azole - Pyrazole - Shiff base - Ketone - Lactam - Secondary aliphatic amine - Aldimine - Aziridine - Enamine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Secondary amine - Azacycle - Organic nitrogen compound - Primary aliphatic amine - Imine - Organonitrogen compound - Organooxygen compound - Primary amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - 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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