Compound Identification
SMILES
CCOC(=O)C1CN1C1=C(C)C(=O)C2=C([C@H](COC(N)=O)C3(OC)[C@@H]4N[C@@H]4CN23)C1=O
InChIKey
InChIKey=ZHRNISWNERANRO-IVPXILKASA-N
Formula
C20H24N4O7
Mass
432.433
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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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
Alpha amino acid esters Indoles Quinones Pyrrolizines Piperazines Aziridinecarboxylic acids Vinylogous amides Pyrrolines Pyrrolidines N-vinylaziridines Carbamate esters Trialkylamines Carboxylic acid esters Dialkylamines Azacyclic compounds Monocarboxylic acids and derivatives Enamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Mitomycin - Alpha-amino acid ester - Alpha-amino acid or derivatives - Indole - Quinone - Pyrrolizine - Aziridinecarboxylic acid - 1,4-diazinane - Piperazine - N-vinylaziridine - Vinylaziridine - Vinylogous amide - Carbamic acid ester - Pyrrolidine - Pyrroline - Amino acid or derivatives - Carboxylic acid ester - Ketone - Tertiary aliphatic amine - Tertiary amine - Azacycle - Enamine - Secondary aliphatic amine - Carboxylic acid derivative - Aziridine - Monocarboxylic acid or derivatives - Secondary amine - Amine - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - 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