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Structure Information
Structure

Compound Identification

SMILES

NC(O)=O.COC12C3NC3CN1C1=C(C2CO)C(=O)C(OCC(C)C)=C(C)C1=O

InChIKey

InChIKey=VGUMEVIJBSJIIA-UHFFFAOYSA-N

Formula

C19H27N3O7

Mass

409.439

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Indolequinones

Intermediate Tree Nodes

Not available

Direct Parent

Mitomycins, mitosane and mitosene derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

Mitosane core - Indole - Quinone - Pyrrolizine - 1,4-diazinane - Piperazine - Vinylogous ester - Vinylogous amide - Pyrroline - Pyrrolidine - Carbamic acid - Carbamic acid derivative - Ketone - Aziridine - Secondary aliphatic amine - Azacycle - Secondary amine - Amine - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Alcohol - Primary alcohol - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as mitomycins, mitosane and mitosene derivatives. These are a group of pyrroloindolediones, which carry a methyl group at the 6-position of their quinone moiety. The mitosane (containing an aziridine) and mitosene server as backbone for mitomycins and their derivatives.

External Descriptors

Not available

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