Compound Identification
SMILES
COC1C2OC(C)(C)OC2OC1C1=CC2=CC=CC=C2OC1=O
InChIKey
InChIKey=IPLYCMIWGXTMIH-UHFFFAOYSA-N
Formula
C17H18O6
Mass
318.325
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 Pyranones and derivatives Ketals Monosaccharides Benzenoids Oxolanes Heteroaromatic compounds 1,3-dioxolanes Lactones Oxacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - 1-benzopyran - Ketal - Pyranone - Monosaccharide - Benzenoid - Pyran - Meta-dioxolane - Heteroaromatic compound - Oxolane - Lactone - Acetal - Dialkyl ether - Ether - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen 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