Compound Identification
SMILES
COC1=C(Cl)C(CO)=C2C=CC(O)=C(C(=O)OC3C\C4=C\C#CC5OC5(C#CC4=C3)C(O)CO)C2=C1
InChIKey
InChIKey=CQTJGCQVQDQRDL-BNNQUZSASA-N
Formula
C27H21ClO8
Mass
508.91
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthalenecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Naphthalenecarboxylic acids and derivatives
Alternative Parents
Naphthols and derivatives Chloronaphthalenes Salicylic acid and derivatives Anisoles 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Ynones Aryl chlorides Vinylogous acids Secondary alcohols 1,2-diols Carboxylic acid esters Oxacyclic compounds Epoxides Dialkyl ethers Aromatic alcohols Hydrocarbon derivatives Organic oxides Organochlorides Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalenecarboxylic acid or derivatives - Chloronaphthalene - 2-naphthol - Salicylic acid or derivatives - Anisole - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Aryl chloride - Aryl halide - Ynone - Vinylogous acid - 1,2-diol - Carboxylic acid ester - Secondary alcohol - Organoheterocyclic compound - Ether - Oxirane - Dialkyl ether - Carboxylic acid derivative - Oxacycle - Organochloride - Organohalogen compound - Aromatic alcohol - Alcohol - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Primary alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthalenecarboxylic acids and derivatives. These are compounds containing a naphthalene moiety, which bears a carboxylic acid group or a derivative at one or more positions. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available