Compound Identification
SMILES
CCNC1=C(C)C(=O)C2=C(C(CO)C3(OC)C4NC4CN23)C1=O
InChIKey
InChIKey=KELFAAODPWXKOO-UHFFFAOYSA-N
Formula
C16H21N3O4
Mass
319.361
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 Piperazines Vinylogous amides Pyrrolines Pyrrolidines Enamines Dialkylamines Aziridines Azacyclic compounds Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Mitomycin - Indole - Pyrrolizine - Quinone - 1,4-diazinane - Piperazine - Vinylogous amide - Pyrrolidine - Pyrroline - Ketone - Azacycle - Secondary amine - Aziridine - Secondary aliphatic amine - Enamine - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Alcohol - Amine - Organonitrogen compound - Organooxygen compound - Primary alcohol - Organic oxide - 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