Compound Identification
SMILES
CC1(C)CC(CS([O-])(=O)=O)C2=C(N1)C=C1OC3=CC4=[NH+]C(C)(C)C=C(CS([O-])(=O)=O)C4=CC3=C(C1=C2)C1=C(C=C(C=C1)C(O)=O)C(O)=O
InChIKey
InChIKey=UPJHRJLLUPMDTA-UHFFFAOYSA-M
Formula
C33H31N2O11S2
Mass
695.73
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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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 M-phthalic acid and derivatives Diarylethers Hydroquinolines Benzoic acids Benzoyl derivatives Secondary alkylarylamines Aralkylamines Sulfonyls Alkanesulfonic acids Organosulfonic acids Amino acids Oxacyclic compounds Carboxylic acids Azacyclic compounds Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Prenylated neoflavonoid - Dibenzopyran - Xanthene - Meta_phthalic_acid - Diaryl ether - Benzopyran - Tetrahydroquinoline - 1-benzopyran - Benzoic acid or derivatives - Benzoic acid - Benzoyl - Aralkylamine - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Amino acid or derivatives - Amino acid - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Organoheterocyclic compound - Ether - Azacycle - Organic oxygen compound - Organic nitrogen compound - Organic salt - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organosulfur compound - Organic oxide - Amine - Organic cation - 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