Compound Identification
SMILES
CC1=CCCC2(C)C(CCC2(O)CN(CC(O)CO)CC2CCCO2)C2=C(C=C(CC(O)CC1)C=C2)C(=O)C1=CC2=CC=CC=C2S1
InChIKey
InChIKey=LJPJRAOTRKOXIX-UHFFFAOYSA-N
Formula
C39H51NO6S
Mass
661.9
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzothiophenes
- Subclass 1-benzothiophenes
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Class
Benzothiophenes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiophenes
Subclass
1-benzothiophenes
Intermediate Tree Nodes
Not available
Direct Parent
1-benzothiophenes
Alternative Parents
Thiophene carboxylic acids and derivatives 2,3,5-trisubstituted thiophenes Aryl ketones Aralkylamines Benzenoids Tetrahydrofurans Tertiary alcohols 1,3-aminoalcohols Heteroaromatic compounds Trialkylamines Secondary alcohols 1,2-aminoalcohols Cyclic alcohols and derivatives Oxacyclic compounds Dialkyl ethers Hydrocarbon derivatives Organic oxides Organopnictogen compounds Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzothiophene - Thiophene carboxylic acid or derivatives - 2,3,5-trisubstituted thiophene - Aryl ketone - Aralkylamine - Benzenoid - 1,3-aminoalcohol - Cyclic alcohol - Tertiary alcohol - Tetrahydrofuran - Thiophene - Heteroaromatic compound - Tertiary aliphatic amine - 1,2-aminoalcohol - Tertiary amine - Secondary alcohol - Ketone - Oxacycle - Dialkyl ether - Ether - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Primary alcohol - Alcohol - Amine - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzothiophenes. These are aromatic heterocyclic compound containing the Benzo[b]thiophene ring system.
External Descriptors
Not available