Compound Identification
SMILES
C[C@H](O)[C@H](C)[C@@H]1O[C@H]1C[C@H]1CO[C@@H](CC(=O)CC(=O)C2=CC=C(OCCCCC(=O)NC3=C4SSC=C4N(C)C3=O)C=C2)[C@H](O)[C@@H]1O
InChIKey
InChIKey=FYUPVXCTEHHHBG-DCVASYPKSA-N
Formula
C33H42N2O10S2
Mass
690.82
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Alkyl-phenylketones
-
Level 7
Phenylketones
-
Level 6
Aryl ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Aryl ketones - Phenylketones
Direct Parent
Alkyl-phenylketones
Alternative Parents
Butyrophenones Phenoxy compounds Phenol ethers Benzoyl derivatives Aryl alkyl ketones N-arylamides Beta-diketones Alkyl aryl ethers Oxanes Fatty amides Monosaccharides N-methylpyrroles Heteroaromatic compounds 1,2-dithioles Secondary alcohols Lactams Secondary carboxylic acid amides 1,2-diols Oxacyclic compounds Epoxides Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - Phenoxy compound - Phenol ether - Benzoyl - N-arylamide - Aryl alkyl ketone - Alkyl aryl ether - 1,3-diketone - Monocyclic benzene moiety - Oxane - N-methylpyrrole - Substituted pyrrole - Fatty acyl - Monosaccharide - Fatty amide - Benzenoid - 1,3-dicarbonyl compound - Heteroaromatic compound - Pyrrole - 1,2-dithiole - Dithiole - 1,2-diol - Carboxamide group - Lactam - Secondary carboxylic acid amide - Secondary alcohol - Azacycle - Ether - Oxirane - Dialkyl ether - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Alcohol - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available