Compound Identification
SMILES
CCCCCCCCCCCCCCCC(=O)OCC(CSSC1=CC=CC=C1COC(=O)N1C2CN3C4=C(C(COC(N)=O)C3(OC)C12)C(=O)C(N)=C(C)C4=O)OC(=O)CCCCCCCCCCCCCCC
InChIKey
InChIKey=OKIIHCYQHJVKIM-UHFFFAOYSA-N
Formula
C58H90N4O11S2
Mass
1083.5
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
Benzyloxycarbonyls Piperazine carboxylic acids Indoles Quinones Pyrrolizines Fatty acid esters Aziridinecarboxylic acids Dicarboxylic acids and derivatives Vinylogous amides Carbamate esters Pyrrolines Pyrrolidines Carboxylic acid esters Organic disulfides Azacyclic compounds Enamines Sulfenyl compounds Hydrocarbon derivatives Organic oxides Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Mitomycin - Benzyloxycarbonyl - Piperazine-1-carboxylic acid - Indole - Pyrrolizine - Quinone - Fatty acid ester - Aziridinecarboxylic acid - Monocyclic benzene moiety - Piperazine - 1,4-diazinane - Benzenoid - Fatty acyl - Dicarboxylic acid or derivatives - Pyrroline - Carbamic acid ester - Vinylogous amide - Pyrrolidine - Amino acid or derivatives - Carboxylic acid ester - Ketone - Organic disulfide - Aziridine - Carboxylic acid derivative - Azacycle - Enamine - Sulfenyl compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organonitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Primary aliphatic amine - Organooxygen compound - Primary amine - Organosulfur 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