Structure Information
Structure

Compound Identification

SMILES

CO[C@]12C3C(CN1C1=C(C2COC(N)=O)C(=O)C(N)=C(C)C1=O)N3C(=O)CCN1C(=O)C=CC1=O

InChIKey

InChIKey=JBVBWOKVFXXZIZ-YRTZZUMRSA-N

Formula

C22H23N5O8

Mass

485.453

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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

Aliphatic heteropolycyclic compounds

Substituents

Mitomycin - Indole - Pyrrolizine - Quinone - Maleimide - 1,4-diazinane - Carboxylic acid imide, n-substituted - Piperazine - Carboxylic acid imide - Dicarboximide - Pyrrolidine - Pyrroline - Vinylogous amide - Carbamic acid ester - Tertiary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Ketone - Carboxylic acid derivative - Aziridine - Azacycle - Enamine - Organooxygen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Organic oxide - Primary amine - Primary aliphatic amine - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Aliphatic 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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