Compound Identification
SMILES
CCCCC1=NC(SC2=CC=CC=C2)=C(C=O)N1CC1=CC2=C(C=C1)C1[C@H]([C@@H](C2C2=CC=CC=C12)C1=NNN=N1)C1=NNN=N1
InChIKey
InChIKey=GUSBPFRBPYOVJM-RAWLKHAVSA-N
Formula
C33H30N10OS
Mass
614.73
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lignans, neolignans and related compounds
- Class Aryltetralin lignans
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Superclass
Lignans, neolignans and related compounds
Kingdom
Organic compounds
Superclass
Lignans, neolignans and related compounds
Class
Aryltetralin lignans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Aryltetralin lignans
Alternative Parents
Anthracenes Diarylthioethers Tetralins 1,2,4,5-tetrasubstituted imidazoles Thiophenol ethers Aryl-aldehydes Carbonylimidazoles Vinylogous thioesters N-substituted imidazoles Benzene and substituted derivatives Tetrazoles Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-aryltetralin lignan - Anthracene - Diarylthioether - Tetralin - 1,2,4,5-tetrasubstituted imidazole - Aryl thioether - Thiophenol ether - Imidazole-4-carbonyl group - Aryl-aldehyde - Monocyclic benzene moiety - N-substituted imidazole - Vinylogous thioester - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Tetrazole - Azacycle - Organoheterocyclic compound - Thioether - Sulfenyl compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Aldehyde - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aryltetralin lignans. These are lignans with a structure based on the 1-phenyltetralin skeleton.
External Descriptors
Not available