Compound Identification
SMILES
CO[C@]12C3C(CN1C1=C(C2COC(N)=O)C(=O)C(N)=C(C)C1=O)N3C(=O)CCN1C(=O)C=CC1=O
InChIKey
InChIKey=JBVBWOKVFXXZIZ-YRTZZUMRSA-N
Formula
C22H23N5O8
Mass
485.453
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 Maleimides Piperazines N-substituted carboxylic acid imides Vinylogous amides Tertiary carboxylic acid amides Pyrrolines Carbamate esters Dicarboximides Azacyclic compounds Aziridines Enamines Monoalkylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Mitomycin - Indole - Pyrrolizine - Quinone - Maleimide - 1,4-diazinane - Carboxylic acid imide, n-substituted - Piperazine - Carboxylic acid imide - Dicarboximide - Pyrrolidine - Pyrroline - Vinylogous amide - Carbamic acid ester - Tertiary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Ketone - Carboxylic acid derivative - Aziridine - Azacycle - Enamine - Organooxygen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Organic oxide - Primary amine - Primary aliphatic amine - Hydrocarbon derivative - Carbonyl group - Organonitrogen 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