Compound Identification
SMILES
COC1=CC(=O)C2=C(O)C3=C(C[C@@H]4[C@@H](O[C@H]5CC[C@H](O[C@H]6CC[C@H](O[C@H]7CC[C@H](O[C@H]8CC[C@H](OC(=O)C(C)C(O)=O)[C@H](C)O8)[C@H](C)O7)[C@H](C)O6)[C@@H](C)O5)C(=O)C(C(C)=O)=C(O)[C@]4(O[C@H]4CC[C@H](O[C@H]5CC[C@H](O)[C@@H](C)O5)[C@@H](C)O4)C3=O)C=C2C1=O
InChIKey
InChIKey=BWIAPPHQSUHPDB-IWCGXAMISA-N
Formula
C61H80O25
Mass
1213.286
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Anthracenes
-
Subclass
Anthraquinones
- Level 5 Anthraquinone glycosides
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Subclass
Anthraquinones
-
Class
Anthracenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Anthracenes
Subclass
Anthraquinones
Intermediate Tree Nodes
Not available
Direct Parent
Anthraquinone glycosides
Alternative Parents
Tetralins Naphthalenes Quinones Aryl alkyl ketones 1-hydroxy-4-unsubstituted benzenoids Cyclohexenones 1,3-dicarbonyl compounds Oxanes Dicarboxylic acids and derivatives Vinylogous esters Vinylogous acids Secondary alcohols Carboxylic acid esters Carboxylic acids Oxacyclic compounds Acetals Enols Organic oxides Aldehydes Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Anthraquinone glycoside - Naphthalene - Tetralin - Quinone - Aryl alkyl ketone - Aryl ketone - 1-hydroxy-4-unsubstituted benzenoid - Cyclohexenone - Dicarboxylic acid or derivatives - Oxane - 1,3-dicarbonyl compound - Vinylogous ester - Vinylogous acid - Secondary alcohol - Cyclic ketone - Ketone - Carboxylic acid ester - Acetal - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Enol - Carboxylic acid - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Aldehyde - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as anthraquinone glycosides. These are organic compounds containing an anthraquinone moiety glycosidically bound to a carbohydrate moiety.
External Descriptors
Not available