Compound Identification
SMILES
CC1=C(N)C(=O)C2=C(N3C[C@H]4N[C@H]4C3=C2COC(N)=O)C1=O
InChIKey
InChIKey=AVQKBCXTSUBBSU-HZGVNTEJSA-N
Formula
C14H14N4O4
Mass
302.29
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
- Subclass Indolequinones
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
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
Pyrrolizines Aryl ketones Aralkylamines Substituted pyrroles Vinylogous amides Heteroaromatic compounds Carbamate esters Enamines Dialkylamines Aziridines Azacyclic compounds Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Mitosane core - Pyrrolizine - Aryl ketone - Aralkylamine - Substituted pyrrole - Pyrrole - Carbamic acid ester - Heteroaromatic compound - Vinylogous amide - Ketone - Secondary amine - Enamine - Secondary aliphatic amine - Aziridine - Azacycle - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Amine - Carbonyl group - Aromatic 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