Compound Identification
SMILES
C[C@@H](NCCC[C@H]1C[C@@H](C2=CC=C(C=C2)C(O)=O)C2=CC=CC=C2O1)C1=CC=C(F)C2=CC=CC=C12
InChIKey
InChIKey=YTXORNHGIVIWCJ-CRDCFYADSA-N
Formula
C31H30FNO3
Mass
483.583
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Neoflavonoids
- Subclass Neoflavans
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Class
Neoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Neoflavonoids
Subclass
Neoflavans
Intermediate Tree Nodes
Not available
Direct Parent
Neoflavans
Alternative Parents
Naphthalenes 1-benzopyrans Benzoic acids Benzoyl derivatives Aralkylamines Alkyl aryl ethers Aryl fluorides Amino acids Oxacyclic compounds Dialkylamines Carboxylic acids Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Neoflavan - Chromane - Benzopyran - Naphthalene - 1-benzopyran - Benzoic acid or derivatives - Benzoic acid - Benzoyl - Aralkylamine - Alkyl aryl ether - Benzenoid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Amino acid or derivatives - Amino acid - Oxacycle - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Ether - Organic nitrogen compound - Amine - Organofluoride - Organic oxygen compound - Organohalogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as neoflavans. These are neoflavonoids with a structure based on a 3,4-dihydro-4-aryl-2H-1-benzopyran skeleton.
External Descriptors
Not available