Compound Identification
SMILES
CO[C@]12[C@H]3N[C@H]3CN1C1=C([C@H]2COC(N)=O)C(=O)C(N)=C(CSC2=CC=CS2)C1=O
InChIKey
InChIKey=NDZQYTFEMGIFRF-ITEYQGMCSA-N
Formula
C19H20N4O5S2
Mass
448.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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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
Indoles Quinones Pyrrolizines Alkylarylthioethers Piperazines Vinylogous amides Thiophenes Pyrrolines Pyrrolidines Carbamate esters Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Aziridines Enamines Dialkylamines Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Mitomycin - Indole - Aryl thioether - Pyrrolizine - Quinone - Alkylarylthioether - 1,4-diazinane - Piperazine - Pyrrolidine - Pyrroline - Heteroaromatic compound - Thiophene - Carbamic acid ester - Vinylogous amide - Ketone - Azacycle - Aziridine - Sulfenyl compound - Secondary aliphatic amine - Thioether - Secondary amine - Enamine - Organic nitrogen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxide - Organooxygen compound - Organic oxygen compound - Organosulfur compound - Hydrocarbon derivative - Primary amine - Carbonyl group - Amine - 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