Compound Identification
SMILES
COC1=CC2=C(C=C1)C=CC1=C2C(C2=CC=C(Cl)C=C2)C2=C(CC(C)(C)CC2=O)O1
InChIKey
InChIKey=RBPSFXSYRCSXEL-UHFFFAOYSA-N
Formula
C26H23ClO3
Mass
418.92
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Neoflavonoids
- Subclass Prenylated neoflavonoids
-
Class
Neoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Neoflavonoids
Subclass
Prenylated neoflavonoids
Intermediate Tree Nodes
Not available
Direct Parent
Prenylated neoflavonoids
Alternative Parents
Xanthenes Naphthopyrans Naphthalenes Anisoles Cyclohexenones Chlorobenzenes Alkyl aryl ethers Pyrans Aryl chlorides Vinylogous esters Oxacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Prenylated neoflavonoid - Dibenzopyran - Naphthopyran - Xanthene - Naphthalene - 1-benzopyran - Benzopyran - Anisole - Phenol ether - Alkyl aryl ether - Cyclohexenone - Chlorobenzene - Halobenzene - Aryl chloride - Benzenoid - Pyran - Monocyclic benzene moiety - Aryl halide - Vinylogous ester - Ketone - Oxacycle - Ether - Organoheterocyclic compound - Organic oxygen compound - Carbonyl group - Organohalogen compound - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as prenylated neoflavonoids. These are neoflavonoids that features a C5-isoprenoid substituent at any position of the A, B, or C ring. Neoflavonoids are compounds with a structure based on the 4-phenylchromene backbone.
External Descriptors
Not available