Compound Identification
SMILES
COC1=CC=CC2=C1C(=O)C1=C(C(O)=C3C=C(C[C@H](OC4CC(CC(C)O4)NC(=O)C(F)(F)F)C3=C1O)C(=O)CO)C2=O
InChIKey
InChIKey=MZPVBBDFQRWCAK-FESVNVFNSA-N
Formula
C29H26F3NO10
Mass
605.519
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 Naphthols and derivatives Anisoles Aryl ketones Alkyl aryl ethers Oxanes Alpha-hydroxy ketones Vinylogous acids Secondary carboxylic acid amides Oxacyclic compounds Acetals Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Primary alcohols Alkyl fluorides Aldehydes Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Anthracycline - Tetracenequinone - 9,10-anthraquinone - 1,4-anthraquinone - Anthracene - 1-naphthol - Aryl ketone - Anisole - Alkyl aryl ether - Benzenoid - Oxane - Vinylogous acid - Alpha-hydroxy ketone - Secondary carboxylic acid amide - Carboxamide group - Ketone - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Acetal - Aldehyde - Organooxygen compound - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Primary alcohol - Hydrocarbon derivative - Alkyl halide - Alcohol - Organonitrogen compound - Alkyl fluoride - Organohalogen compound - Organofluoride - 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