Compound Identification
SMILES
NC(=O)C1=CN=CC=C1.CC(C)=CCC\C(C)=C\CC\C(C)=C\CSC[C@H](NC(=O)\C=C\C(O)=O)C(O)=O
InChIKey
InChIKey=IXDOZPRGVGUJAT-PONVDXFQSA-N
Formula
C28H39N3O6S
Mass
545.7
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Sesquiterpenoids
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Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Sesquiterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Sesquiterpenoids
Alternative Parents
N-acyl-L-alpha-amino acids Cysteine and derivatives Nicotinamides Branched fatty acids Unsaturated fatty acids Dicarboxylic acids and derivatives N-acyl amines Heteroaromatic compounds Secondary carboxylic acid amides Primary carboxylic acid amides Azacyclic compounds Dialkylthioethers Sulfenyl compounds Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Not available
Substituents
Sesquiterpenoid - Farsesane sesquiterpenoid - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - N-acyl-l-alpha-amino acid - Cysteine or derivatives - Alpha-amino acid or derivatives - Nicotinamide - Pyridinecarboxamide - Pyridine carboxylic acid or derivatives - Branched fatty acid - Dicarboxylic acid or derivatives - N-acyl-amine - Fatty acyl - Pyridine - Fatty acid - Unsaturated fatty acid - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Primary carboxylic acid amide - Carboxylic acid derivative - Sulfenyl compound - Carboxylic acid - Dialkylthioether - Organoheterocyclic compound - Thioether - Azacycle - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units.
External Descriptors
Not available