Compound Identification
SMILES
COC1=C(OC(=O)C2=CC3=C(C(=O)S2)C(OC)=C(OC)C=C3)C=CC(C=O)=C1
InChIKey
InChIKey=MDDVNIJAVPEFNE-UHFFFAOYSA-N
Formula
C20H16O7S
Mass
400.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Isothiochromenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isothiochromenes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Isothiochromenes
Alternative Parents
Phenol esters 2-benzothiopyrans Phenoxy compounds Methoxybenzenes Benzoyl derivatives Benzaldehydes Anisoles Alkyl aryl ethers Vinylogous esters Heteroaromatic compounds Carbothioic S-lactones Carboxylic acid esters Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isothiochromene - Phenol ester - Benzothiopyran - 2-benzothiopyran - Anisole - Benzaldehyde - Benzoyl - Phenoxy compound - Phenol ether - Methoxybenzene - Aryl-aldehyde - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Carbothioic s-lactone - Vinylogous ester - Heteroaromatic compound - Carboxylic acid ester - Ether - Carboxylic acid derivative - Organic oxygen compound - Organooxygen compound - Aldehyde - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isothiochromenes. These are organic heterocyclic compounds containing an isothiochromene moiety.
External Descriptors
Not available