Compound Identification
SMILES
COC12[C@@H]3N[C@@H]3CN1C1=C([C@@H]2COC(N)=O)C(=O)C(N2CC2C2=CC=CC=C2)=C(C)C1=O
InChIKey
InChIKey=KXTAYPOOSXGBIR-FAJSIPSHSA-N
Formula
C23H24N4O5
Mass
436.468
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
-
Subclass
Indolequinones
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Level 5
Mitomycins, mitosane and mitosene derivatives
- Level 6 Mitomycins
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Level 5
Mitomycins, mitosane and mitosene derivatives
-
Subclass
Indolequinones
-
Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
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
Phenylaziridines Indoles Quinones Pyrrolizines Aralkylamines Piperazines Benzene and substituted derivatives Vinylogous amides Pyrrolines Pyrrolidines N-vinylaziridines Carbamate esters Trialkylamines Azacyclic compounds Enamines Dialkylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Mitomycin - Indole - Phenylaziridine - Pyrrolizine - Quinone - Aralkylamine - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Benzenoid - N-vinylaziridine - Pyrrolidine - Pyrroline - Vinylaziridine - Vinylogous amide - Carbamic acid ester - Tertiary aliphatic amine - Tertiary amine - Ketone - Aziridine - Secondary aliphatic amine - Azacycle - Secondary amine - Enamine - Amine - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Aromatic 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