Compound Identification
SMILES
CCC[C@@H](C)\C=C(\C)C(=O)O[C@@H]1[C@H](C)O[C@H](C[C@@]1(C)O)O[C@H]1CC[C@H](O[C@@H]2C(=O)C(C(C)=O)=C(O)[C@@]3(O)C(=O)C4=C(O)C5=C(C(C)=C4C[C@@]23O)C(=O)C(OC)=CC5=O)O[C@@H]1C
InChIKey
InChIKey=ZYPYHMZLLIDAAL-WNMWLNICSA-N
Formula
C44H54O17
Mass
854.899
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Anthracenes
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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
Disaccharides O-glycosyl compounds Tetralins Naphthalenes Aryl alkyl ketones Quinones Cyclohexenones Fatty acid esters Oxanes Vinylogous esters Vinylogous acids Tertiary alcohols Enoate esters Polyols Enols Acetals Monocarboxylic acids and derivatives Oxacyclic compounds Aldehydes Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Anthraquinone glycoside - O-glycosyl compound - Disaccharide - Glycosyl compound - Naphthalene - Tetralin - Quinone - Aryl alkyl ketone - Aryl ketone - Cyclohexenone - Fatty acid ester - Fatty acyl - Oxane - Vinylogous acid - Tertiary alcohol - Vinylogous ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Cyclic ketone - Ketone - Carboxylic acid ester - Acetal - Carboxylic acid derivative - Enol - Oxacycle - Organoheterocyclic compound - Polyol - Monocarboxylic acid or derivatives - Organic oxide - Hydrocarbon derivative - Aldehyde - Organic oxygen compound - Carbonyl group - Alcohol - Organooxygen compound - 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