Compound Identification
SMILES
CC(C1CCC2(C)CC3=C(N=C(NCCC4=CC=CC=N4)S3)C(C)C2C1O)C(=O)N(C)CC#C
InChIKey
InChIKey=DCNJCHRLLKCIQA-UHFFFAOYSA-N
Formula
C27H36N4O2S
Mass
480.67
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
Naphthothiazoles Secondary alkylarylamines Pyridines and derivatives 2-amino-1,3-thiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Secondary alcohols Cyclic alcohols and derivatives Amino acids and derivatives Azacyclic compounds Acetylides Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Sesquiterpenoid - Naphthothiazole - Secondary aliphatic/aromatic amine - Pyridine - 1,3-thiazol-2-amine - Azole - Cyclic alcohol - Heteroaromatic compound - Thiazole - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Secondary alcohol - Carboxylic acid derivative - Acetylide - Azacycle - Organoheterocyclic compound - Secondary amine - Organonitrogen compound - Organic oxide - Amine - Alcohol - Organopnictogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic 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