Compound Identification
SMILES
COC1=CC(=CC(OC)=C1O)C1C(C(C)=O)C(C)(O)OC2=CC3=C(OCO3)C=C12
InChIKey
InChIKey=AHZHEDSFTYCVOK-UHFFFAOYSA-N
Formula
C21H22O8
Mass
402.399
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Neoflavonoids
- Subclass Neoflavans
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Class
Neoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Neoflavonoids
Subclass
Neoflavans
Intermediate Tree Nodes
Not available
Direct Parent
Neoflavans
Alternative Parents
Methoxyphenols Dimethoxybenzenes 1-benzopyrans Benzodioxoles Phenoxy compounds Anisoles Alkyl aryl ethers Ketones Hemiacetals Oxacyclic compounds Acetals Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Neoflavan - Chromane - Benzopyran - Methoxyphenol - 1-benzopyran - Dimethoxybenzene - M-dimethoxybenzene - Benzodioxole - Methoxybenzene - Anisole - Phenol ether - Phenoxy compound - Alkyl aryl ether - Phenol - Monocyclic benzene moiety - Benzenoid - Ketone - Hemiacetal - Ether - Acetal - Organoheterocyclic compound - Oxacycle - Carbonyl group - Aldehyde - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as neoflavans. These are neoflavonoids with a structure based on a 3,4-dihydro-4-aryl-2H-1-benzopyran skeleton.
External Descriptors
Not available