Compound Identification
SMILES
CCCCOC1=CC=C(C=C1)C1(OC2=C(C=C1)C1=C(C3=C(C=CC(=C3)N3CCNCC3)C1(C)C)C1=C2C=C(C=C1)C(F)(F)F)C1=CC=C(F)C=C1
InChIKey
InChIKey=YTOJFACQWPSVFR-UHFFFAOYSA-N
Formula
C43H40F4N2O2
Mass
692.799
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
- Subclass Flav-3-enes
-
Class
Flavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flav-3-enes
Intermediate Tree Nodes
Not available
Direct Parent
Flav-3-enes
Alternative Parents
Naphthopyrans Diphenylmethanes Fluorenes N-arylpiperazines 1-benzopyrans Naphthalenes Phenoxy compounds Phenol ethers Dialkylarylamines Alkyl aryl ethers Fluorobenzenes Aryl fluorides Pyrans Oxacyclic compounds Dialkylamines Azacyclic compounds Organofluorides Alkyl fluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Flav-3-ene - Naphthopyran - Fluorene - Diphenylmethane - N-arylpiperazine - Naphthalene - 1-benzopyran - Benzopyran - Phenol ether - Phenoxy compound - Dialkylarylamine - Alkyl aryl ether - Fluorobenzene - Halobenzene - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Pyran - Piperazine - 1,4-diazinane - Tertiary amine - Oxacycle - Azacycle - Secondary aliphatic amine - Organoheterocyclic compound - Secondary amine - Ether - Amine - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flav-3-enes. These are flavonoids with a structure based on the 2-phenylchromene skeleton, with a double bond between the C3 and C4 carbon atoms of the chromene moiety.
External Descriptors
Not available