Compound Identification
SMILES
[Cl-].CC1CC(C)(C)[NH+]=C2C=C3OC4=CC5=C(C=C4C(=C3C=C12)C1=C(C=CC(=C1)C(O)=O)C(O)=O)C(C)CC(C)(C)N5
InChIKey
InChIKey=IAHUWBMWEOWGGZ-UHFFFAOYSA-N
Formula
C33H35ClN2O5
Mass
575.1
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
Xanthenes P-phthalic acid and derivatives Diarylethers Hydroquinolines Benzoic acids Benzoyl derivatives Secondary alkylarylamines Aralkylamines Amino acids Oxacyclic compounds Carboxylic acids Azacyclic compounds Organic chloride salts Organic zwitterions Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Prenylated neoflavonoid - Xanthene - Dibenzopyran - Para_phthalic_acid - Diaryl ether - 1-benzopyran - Tetrahydroquinoline - Benzopyran - Benzoic acid or derivatives - Benzoic acid - Benzoyl - Secondary aliphatic/aromatic amine - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Amino acid or derivatives - Amino acid - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Ether - Secondary amine - Organic chloride salt - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Amine - 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