Structure Information
Structure

Compound Identification

SMILES

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

InChIKey

InChIKey=YIFIDWHAVPVPSD-UHFFFAOYSA-N

Formula

C17H22N4O6

Mass

378.385

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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 - 1,4-diazinane - Piperazine - Pyrrolidine - Pyrroline - Carbamic acid ester - Vinylogous amide - Ketone - Carbonic acid derivative - Alkanolamine - Secondary amine - Azacycle - Aziridine - Secondary aliphatic amine - Enamine - Amine - Organonitrogen compound - Primary aliphatic amine - Organopnictogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Primary alcohol - Carbonyl group - Primary amine - Alcohol - 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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