Compound Identification
SMILES
O=C(ON1C(=O)CCC1=O)C1=CC=CC=C1C1=C2C=CC(C=C2OC2=C1C=CC(=C2)C(\C#N)=C1\NC2=CC=CC=C2S1)C(\C#N)=C1\NC2=CC=CC=C2S1
InChIKey
InChIKey=SKZBFTSGLDGOEN-NXCROBSJSA-N
Formula
C42H25N5O5S2
Mass
743.81
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Neoflavonoids
- Subclass Prenylated neoflavonoids
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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
Neoflavenes Xanthenes Benzoic acids and derivatives Benzothiazoles Aryl thioethers Benzoyl derivatives Pyrrolidine-2-ones Thiazoles Dicarboximides Lactams Ketene acetals Nitriles Azacyclic compounds Oxacyclic compounds Carbonyl compounds Amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Prenylated neoflavonoid - Neoflavene - Xanthene - Dibenzopyran - 1-benzopyran - Benzopyran - 1,3-benzothiazole - Benzoic acid or derivatives - Benzo-thiazole - 1,2-benzothiazole - Benzoyl - Aryl thioether - 2-pyrrolidone - Pyrrolidone - Benzenoid - Monocyclic benzene moiety - Thiazole - Pyrrolidine - Dicarboximide - Lactam - Ketene acetal or derivatives - Carbonitrile - Nitrile - Organoheterocyclic compound - Azacycle - Oxacycle - Carboxylic acid derivative - Amine - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - 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