Compound Identification
SMILES
FC1=C(C=CC(=C1)N1CCOCC1)C1(OC2=C(C=C1)C1=CC=CC=C1C=C2)C1=CC=CS1
InChIKey
InChIKey=FHNOESQONNKTQR-UHFFFAOYSA-N
Formula
C27H22FNO2S
Mass
443.54
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
- Subclass Flav-3-enes
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Class
Flavonoids
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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 Phenylmorpholines 1-benzopyrans Naphthalenes Aniline and substituted anilines Dialkylarylamines Alkyl aryl ethers Fluorobenzenes Pyrans Aryl fluorides Thiophenes Heteroaromatic compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Flav-3-ene - Naphthopyran - Phenylmorpholine - Benzopyran - Naphthalene - 1-benzopyran - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Morpholine - Oxazinane - Pyran - Benzenoid - Thiophene - Heteroaromatic compound - Tertiary amine - Organoheterocyclic compound - Dialkyl ether - Ether - Oxacycle - Azacycle - Organic oxygen compound - Organofluoride - Organooxygen compound - Amine - Hydrocarbon derivative - Organohalogen compound - Organic nitrogen compound - Organonitrogen 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