Structure Information
Structure

Compound Identification

SMILES

COC12C3NC3CN1C1=C(C2COC(N)=O)C(=O)C(NC2CONC2=O)=C(C)C1=O

InChIKey

InChIKey=YDURADBHPVCWCJ-UHFFFAOYSA-N

Formula

C18H21N5O7

Mass

419.394

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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 - Alpha-amino acid or derivatives - Indole - Pyrrolizine - Quinone - 1,4-diazinane - Oxazolidinone - Piperazine - Isoxazolidine - Pyrrolidine - Pyrroline - Vinylogous amide - Carbamic acid ester - Amino acid or derivatives - Carbonic acid derivative - Ketone - Aziridine - Oxacycle - Secondary amine - Azacycle - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Amine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - 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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