Compound Identification
SMILES
CC(C)[C@H]1CC[C@H](C[C@H]1C(O)=O)c1nc(-c2ccc(cc2)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12
InChIKey
InChIKey=PAQMIHDIOFLBAZ-HMXCVIKNSA-N
Formula
C29H29F3N6O3
Mass
566.585
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
Subclass
Monoterpenoids
- Level 5 Bicyclic monoterpenoids
-
Subclass
Monoterpenoids
-
Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Monoterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Bicyclic monoterpenoids
Alternative Parents
Menthane monoterpenoids Aromatic monoterpenoids Imidazo[1,5-a]pyrazines Benzamides Polyhalopyridines Benzoyl derivatives Methylpyridines Methyl-branched fatty acids Hydroxypyridines Heterocyclic fatty acids Halogenated fatty acids 2-halopyridines Pyrazines Imidolactams Heteroaromatic compounds Azoles Amino acids Monocarboxylic acids and derivatives Carboxylic acids Carboxylic acid amides Azacyclic compounds Primary amines Organopnictogen compounds Organooxygen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
P-menthane monoterpenoid - Bicyclic monoterpenoid - Aromatic monoterpenoid - Imidazo[1,5-a]pyrazine - Benzoic acid or derivatives - Benzamide - Polyhalopyridine - Benzoyl - 2-halopyridine - Methylpyridine - Hydroxypyridine - Methyl-branched fatty acid - Heterocyclic fatty acid - Halogenated fatty acid - Branched fatty acid - Fatty acyl - Fatty acid - Imidolactam - Benzenoid - Pyridine - Pyrazine - Monocyclic benzene moiety - Heteroaromatic compound - Azole - Amino acid - Carboxamide group - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other.
External Descriptors
Not available