Compound Identification
SMILES
C[C@@H]1O[C@@H](O[C@H]2C[C@](O)(CO)CC3=C(O)C4=C(C(O)=C23)C(=O)C2=CC=CC=C2C4=O)[C@H](I)[C@H](O)[C@H]1O
InChIKey
InChIKey=IJWZCUDUUDYUBR-IWGZIANCSA-N
Formula
C25H25IO10
Mass
612.369
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Anthracyclines
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Anthracyclines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Anthracyclines
Alternative Parents
Tetracenequinones Anthraquinones Hexoses Tetralins O-quinomethanes M-quinomethanes Aryl ketones Cyclohexenones Oxanes Beta-hydroxy ketones Alpha-branched alpha,beta-unsaturated ketones Vinylogous acids Tertiary alcohols Enones Acryloyl compounds Secondary alcohols Iodohydrins Cyclic alcohols and derivatives Polyols Oxacyclic compounds Organoiodides Organic oxides Hydrocarbon derivatives Alkyl iodides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Anthracyclinone-skeleton - Tetracenequinone - 1,4-anthraquinone - 9,10-anthraquinone - Anthracene - Hexose monosaccharide - Tetralin - Aryl ketone - Quinomethane - O-quinomethane - M-quinomethane - Cyclohexenone - Alpha-branched alpha,beta-unsaturated-ketone - Benzenoid - Oxane - Monosaccharide - Beta-hydroxy ketone - Vinylogous acid - Alpha,beta-unsaturated ketone - Tertiary alcohol - Enone - Cyclic alcohol - Acryloyl-group - Secondary alcohol - Ketone - Iodohydrin - Halohydrin - Oxacycle - Organoheterocyclic compound - Polyol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organoiodide - Organohalogen compound - Alkyl iodide - Alkyl halide - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as anthracyclines. These are polyketides containing a tetracenequinone ring structure with a sugar attached by glycosidic linkage.
External Descriptors
Not available