Compound Identification
SMILES
CO[C@]12[C@@H]3[C@H](CN1C1=C([C@H]2COC(N)=O)C(=O)C2=C(CSCCN2)C1=O)N3C(C)=O
InChIKey
InChIKey=WCKANWIZAMLQFY-BRODISEOSA-N
Formula
C19H22N4O6S
Mass
434.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
-
Subclass
Indolequinones
-
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 Para thiazepines Piperazines Vinylogous amides Tertiary carboxylic acid amides Pyrrolines Pyrrolidines Acetamides Carbamate esters Azacyclic compounds Aziridines Enamines Dialkylthioethers Dialkylamines Hydrocarbon derivatives Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Mitomycin - Indole - Pyrrolizine - Quinone - Para-thiazepine - 1,4-diazinane - Piperazine - Vinylogous amide - Carbamic acid ester - Pyrrolidine - Tertiary carboxylic acid amide - Pyrroline - Acetamide - Ketone - Carboxamide group - Amino acid or derivatives - Dialkylthioether - Enamine - Aziridine - Secondary aliphatic amine - Carboxylic acid derivative - Thioether - Secondary amine - Azacycle - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic oxide - Amine - 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