Compound Identification
SMILES
C[C@H]1OC2=C([C@@H](O)[C@H]1C)C1=C(C3=C2[C@H]2[C@@H](O3)C2(C)C)C(=CC(=O)O1)C1=CC=CC=C1
InChIKey
InChIKey=NDJILOHYAHLIPO-CTKLGVQLSA-N
Formula
C25H24O5
Mass
404.462
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Neoflavonoids
- Subclass Pyranoneoflavonoids
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Class
Neoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Neoflavonoids
Subclass
Pyranoneoflavonoids
Intermediate Tree Nodes
Not available
Direct Parent
Pyranoneoflavonoids
Alternative Parents
Neoflavones Angular pyranocoumarins Pyranochromenes Angular furanocoumarins Coumarans Pyranones and derivatives Alkyl aryl ethers Benzene and substituted derivatives Heteroaromatic compounds Secondary alcohols Lactones Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyranoneoflavonoid - 4-phenylcoumarin - Angular pyranocoumarin - Pyranocoumarin - Angular furanocoumarin - Furanocoumarin - Pyranochromene - Coumarin - Chromane - Benzopyran - 1-benzopyran - Coumaran - Alkyl aryl ether - Pyranone - Monocyclic benzene moiety - Benzenoid - Pyran - Heteroaromatic compound - Lactone - Secondary alcohol - Organoheterocyclic compound - Ether - Oxacycle - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyranoneoflavonoids. These are compounds containing a pyran ring fused to either ring A, B, or C of the neoflavonoid skeleton. Neoflavonoids are compounds with a structure based on the 4-phenylchromene backbone.
External Descriptors
Not available