Compound Identification
SMILES
Cl.COC1=CC=CC2=C1C(=O)C1=C(C(O)=C3CC(O)(CC(OC4CC(N)C(O)C(C)O4)C3=C1O)C(\C)=N\N=C(/C)CC(C)C)C2=O
InChIKey
InChIKey=BYISRNPMNHODPW-OOEYYVQKSA-N
Formula
C33H42ClN3O9
Mass
660.16
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 Aminoglycosides Anthraquinones Hexoses O-glycosyl compounds Tetralins Anisoles Ketazines Aryl ketones Alkyl aryl ethers Oxanes Vinylogous acids Tertiary alcohols Secondary alcohols 1,2-aminoalcohols Polyols Acetals Oxacyclic compounds Organic oxides Organopnictogen compounds Aldehydes Monoalkylamines Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Anthracycline - Anthracyclinone-skeleton - Aminoglycoside core - Tetracenequinone - 9,10-anthraquinone - 1,4-anthraquinone - Anthracene - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Tetralin - Ketazine - Anisole - Aryl ketone - Amino saccharide - Alkyl aryl ether - Benzenoid - Azine - Monosaccharide - Oxane - Tertiary alcohol - Vinylogous acid - Secondary alcohol - Ketone - 1,2-aminoalcohol - Ether - Organoheterocyclic compound - Oxacycle - Acetal - Polyol - Primary amine - Hydrochloride - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Primary aliphatic amine - Organic nitrogen compound - Amine - Organonitrogen compound - Aldehyde - Alcohol - Organooxygen compound - 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