Compound Identification
SMILES
COC(=O)C(CC1=C(Br)C(=O)C2=C(C(O)=CC=C2)C1=O)C(=O)CC1(C)OCCO1
InChIKey
InChIKey=HVDQVPFAFZQYAM-UHFFFAOYSA-N
Formula
C20H19BrO8
Mass
467.268
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
- Subclass Naphthoquinones
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Class
Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthoquinones
Intermediate Tree Nodes
Not available
Direct Parent
Naphthoquinones
Alternative Parents
Quinones Aryl ketones 1-hydroxy-4-unsubstituted benzenoids Ketals 1-hydroxy-2-unsubstituted benzenoids Fatty acid esters Beta-keto acids and derivatives 1,3-dicarbonyl compounds Vinylogous halides Vinylogous acids Alpha-haloketones 1,3-dioxolanes Methyl esters Bromoalkenes Monocarboxylic acids and derivatives Oxacyclic compounds Vinyl bromides Aldehydes Hydrocarbon derivatives Organic oxides Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Naphthoquinone - Quinone - Aryl ketone - Beta-keto acid - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Fatty acid ester - Ketal - Keto acid - 1,3-dicarbonyl compound - Fatty acyl - Alpha-haloketone - Vinylogous acid - Vinylogous halide - Methyl ester - Meta-dioxolane - Carboxylic acid ester - Ketone - Bromoalkene - Haloalkene - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Acetal - Vinyl halide - Monocarboxylic acid or derivatives - Vinyl bromide - Carbonyl group - Aldehyde - Organic oxide - Organohalogen compound - Organobromide - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthoquinones. These are compounds containing a naphthohydroquinone moiety, which consists of a benzene ring linearly fused to a bezene-1,4-dione (quinone).
External Descriptors
Not available