Compound Identification
SMILES
CCOP(=O)(CC1=CC(=O)OC2=C1C=CC(OC)=C2)OCC
InChIKey
InChIKey=NCBPJHNNDSAWBL-UHFFFAOYSA-N
Formula
C15H19O6P
Mass
326.285
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Coumarins and derivatives
Alternative Parents
1-benzopyrans Anisoles Pyranones and derivatives Dialkyl alkylphosphonates Alkyl aryl ethers Phosphonic acid esters Heteroaromatic compounds Lactones Oxacyclic compounds Organophosphorus compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - 1-benzopyran - Anisole - Phenol ether - Alkyl aryl ether - Dialkyl alkylphosphonate - Phosphonic acid diester - Pyranone - Benzenoid - Pyran - Phosphonic acid ester - Heteroaromatic compound - Organophosphonic acid derivative - Lactone - Organoheterocyclic compound - Ether - Oxacycle - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organophosphorus compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one).
External Descriptors
Not available