Compound Identification
SMILES
CO[C@@]12[C@@H]3N[C@@H]3CN1C1=C([C@@H]2COC(N)=O)C(=O)C(NC2=NC(C)=CS2)=C(C)C1=O
InChIKey
InChIKey=GJMYQLAUNLWMMV-ATEKAGDGSA-N
Formula
C19H21N5O5S
Mass
431.47
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 2,4-disubstituted thiazoles 2-amino-1,3-thiazoles Piperazines Vinylogous amides Pyrrolines Carbamate esters Heteroaromatic compounds Pyrrolidines Dialkylamines Enamines Aziridines Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Mitomycin - Indole - Pyrrolizine - Quinone - 2,4-disubstituted 1,3-thiazole - 1,4-diazinane - Piperazine - 1,3-thiazol-2-amine - Azole - Heteroaromatic compound - Pyrrolidine - Pyrroline - Vinylogous amide - Thiazole - Carbamic acid ester - Ketone - Enamine - Aziridine - Azacycle - Secondary amine - Secondary aliphatic amine - Amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - 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