Compound Identification
SMILES
COC1=C(N)C=C(NC2=C(C)C(=O)C3=C([C@H](COC(N)=O)C4(OC)[C@@H]5N[C@@H]5CN34)C2=O)C=C1
InChIKey
InChIKey=HTOIDRYSERIDIM-NVIZMAGOSA-N
Formula
C22H25N5O6
Mass
455.471
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
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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
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Subclass
Indolequinones
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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
Aminophenyl ethers Indoles Methoxyanilines Quinones Pyrrolizines Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Piperazines Vinylogous amides Pyrrolines Carbamate esters Pyrrolidines Tertiary amines Enamines Dialkylamines Aziridines Azacyclic compounds Hydrocarbon derivatives Primary amines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Mitomycin - Aminophenyl ether - Indole - Methoxyaniline - Phenoxy compound - Anisole - Methoxybenzene - Aniline or substituted anilines - Phenol ether - Pyrrolizine - Quinone - Alkyl aryl ether - Monocyclic benzene moiety - 1,4-diazinane - Benzenoid - Piperazine - Vinylogous amide - Carbamic acid ester - Pyrrolidine - Pyrroline - Tertiary amine - Ketone - Secondary amine - Aziridine - Secondary aliphatic amine - Enamine - Ether - Azacycle - Primary amine - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - 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