Compound Identification
SMILES
CC1(C)CN(C2=C1C1=C(C=C3C(O1)=C1C(C4=CC=CC=C34)=[N+](CC1(C)C)C1=CC=C(C=C1)S([O-])(=O)=O)C1=CC=CC=C21)C1=CC=C(C=C1)C(O)=O
InChIKey
InChIKey=ANGQLVTUEHKCNW-UHFFFAOYSA-N
Formula
C42H34N2O6S
Mass
694.8
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Isoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Isoflavonoids
Alternative Parents
Xanthenes Naphthopyrans Alkyldiarylamines Diarylethers Benzenesulfonic acids and derivatives Aminobenzoic acids Naphthalenes Benzenesulfonyl compounds 1-sulfo,2-unsubstituted aromatic compounds Benzoic acids Indoles and derivatives Benzoyl derivatives Aniline and substituted anilines Aralkylamines Pyrans Organosulfonic acids Sulfonyls Amino acids Oxacyclic compounds Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic zwitterions Organic salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoflavonoid - Naphthopyran - Dibenzopyran - Xanthene - Alkyldiarylamine - Diaryl ether - Aminobenzoic acid - Aminobenzoic acid or derivatives - Naphthalene - Benzenesulfonate - 1-benzopyran - Benzopyran - Benzenesulfonyl group - Indole or derivatives - Arylsulfonic acid or derivatives - Benzoic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Benzoic acid - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Benzoyl - Aralkylamine - Pyran - Benzenoid - Monocyclic benzene moiety - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Amino acid or derivatives - Tertiary amine - Amino acid - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Organic zwitterion - Organic salt - Organic oxygen compound - Organic nitrogen compound - Amine - Organic oxide - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoflavonoids. These are natural products derived from 3-phenylchromen-4-one.
External Descriptors
Not available