Compound Identification
SMILES
CCOC(=O)C1=CC=C(N[C@@H]2OC3=CC4=C(OCO4)C=C3[C@@H]([C@H]2C)C2=CC(OC)=C(OC)C(OC)=C2)C=C1
InChIKey
InChIKey=HCTURDIOIWGOOY-HNWNSCGYSA-N
Formula
C29H31NO8
Mass
521.566
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Neoflavonoids
- Subclass Neoflavans
-
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
1-benzopyrans Benzoic acid esters Benzodioxoles Phenylalkylamines Phenoxy compounds Methoxybenzenes Benzoyl derivatives Anisoles Aniline and substituted anilines Secondary alkylarylamines Alkyl aryl ethers Carboxylic acid esters Oxacyclic compounds Acetals Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Neoflavan - Benzoate ester - Chromane - Benzopyran - 1-benzopyran - Benzodioxole - Benzoic acid or derivatives - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Aniline or substituted anilines - Phenylalkylamine - Methoxybenzene - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Carboxylic acid ester - Organoheterocyclic compound - Oxacycle - Acetal - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Organic oxygen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - 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