Structure Information
Structure

Compound Identification

SMILES

CCCCCCCCCCCCCCCC(=O)OCC(CSSC1=CC=CC=C1COC(=O)N1C2CN3C4=C(C(COC(N)=O)C3(OC)C12)C(=O)C(N)=C(C)C4=O)OC(=O)CCCCCCCCCCCCCCC

InChIKey

InChIKey=OKIIHCYQHJVKIM-UHFFFAOYSA-N

Formula

C58H90N4O11S2

Mass

1083.5

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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 - Benzyloxycarbonyl - Piperazine-1-carboxylic acid - Indole - Pyrrolizine - Quinone - Fatty acid ester - Aziridinecarboxylic acid - Monocyclic benzene moiety - Piperazine - 1,4-diazinane - Benzenoid - Fatty acyl - Dicarboxylic acid or derivatives - Pyrroline - Carbamic acid ester - Vinylogous amide - Pyrrolidine - Amino acid or derivatives - Carboxylic acid ester - Ketone - Organic disulfide - Aziridine - Carboxylic acid derivative - Azacycle - Enamine - Sulfenyl compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organonitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Primary aliphatic amine - Organooxygen compound - Primary amine - Organosulfur 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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