Compound Identification
SMILES
CC1(C)CN(C2=C1C1=C(C=C3C(O1)=C1C(C4=CC=CC=C34)=[N+](CC1(C)C)C1=CC=C(CCCCCC(O)=O)C=C1)C1=CC=CC=C21)C1=CC=C(C=C1)S(O)(=O)=O
InChIKey
InChIKey=GFKFLFVYWBQKTF-UHFFFAOYSA-O
Formula
C47H45N2O6S
Mass
765.94
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 Naphthalenes Benzenesulfonyl compounds Indoles and derivatives 1-sulfo,2-unsubstituted aromatic compounds Aniline and substituted anilines Medium-chain fatty acids Heterocyclic fatty acids Aralkylamines Pyrans Organosulfonic acids Sulfonyls Amino acids Oxacyclic compounds Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoflavonoid - Xanthene - Naphthopyran - Dibenzopyran - Alkyldiarylamine - Diaryl ether - Naphthalene - 1-benzopyran - Benzenesulfonate - Benzopyran - 1-sulfo,2-unsubstituted aromatic compound - Indole or derivatives - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Aniline or substituted anilines - Medium-chain fatty acid - Tertiary aliphatic/aromatic amine - Heterocyclic fatty acid - Aralkylamine - Benzenoid - Fatty acid - Pyran - Monocyclic benzene moiety - Fatty acyl - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Amino acid or derivatives - Tertiary amine - Amino acid - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Oxacycle - Monocarboxylic acid or derivatives - Azacycle - Organooxygen compound - Organic oxide - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organosulfur compound - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organic cation - 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