Compound Identification
SMILES
COC1=CC=CC2=C1C(=O)[C@@]13C[C@]1(C2=O)C1=C(C=C3)[C@H](OC(C)=O)[C@H](C)[C@H](O)C1=O
InChIKey
InChIKey=IABFCFVKJYQRCS-VOIRDZSXSA-N
Formula
C23H20O7
Mass
408.406
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Anthracenes
- Subclass Anthraquinones
-
Class
Anthracenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Anthracenes
Subclass
Anthraquinones
Intermediate Tree Nodes
Not available
Direct Parent
Anthraquinones
Alternative Parents
Tetralins Naphthalenes Quinones Aryl alkyl ketones Anisoles Cyclohexenones Alkyl aryl ethers Secondary alcohols Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Anthraquinone - 9,10-anthraquinone - Tetralin - Naphthalene - Aryl alkyl ketone - Aryl ketone - Quinone - Anisole - Cyclohexenone - Alkyl aryl ether - Secondary alcohol - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as anthraquinones. These are organic compounds containing either anthracene-9,10-quinone, 1,4-anthraquinone, or 1,2-anthraquinone.
External Descriptors
Not available