Compound Identification
SMILES
CC1CC[C@@]23C[C@H](OC(=O)C(Cl)Cl)C(=O)C2[C@]1(C)[C@@H](C[C@@](C)(C=C)[C@@H](OC(=O)C(F)(F)F)[C@@H]3C)OC(=O)NC(=O)C1=CN=C(NC(C)=O)C=C1
InChIKey
InChIKey=MCEDGPQRASLVBW-WKGPSUTJSA-N
Formula
C33H38Cl2F3N3O9
Mass
748.57
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
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Subclass
Diterpenoids
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Level 5
Mutilane diterpenoids
- Level 6 Mutilin derivatives
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Level 5
Mutilane diterpenoids
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Subclass
Diterpenoids
-
Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Diterpenoids
Intermediate Tree Nodes
Mutilane diterpenoids
Direct Parent
Mutilin derivatives
Alternative Parents
N-acetylarylamines Nicotinamides Alpha-acyloxy ketones Dicarboxylic acids and derivatives Imidolactams Acetamides Alpha-halocarboxylic acid derivatives Carbamate esters Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Ketones Azacyclic compounds Organofluorides Alkyl fluorides Alkyl chlorides Hydrocarbon derivatives Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Mutilin skeleton - N-acetylarylamine - Nicotinamide - Pyridine carboxylic acid or derivatives - N-arylamide - Alpha-acyloxy ketone - Dicarboxylic acid or derivatives - Imidolactam - Pyridine - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Heteroaromatic compound - Acetamide - Carbamic acid ester - Secondary carboxylic acid amide - Ketone - Carboxylic acid ester - Carboxamide group - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organooxygen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Alkyl chloride - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organofluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as mutilin derivatives. These are tricyclic diterpenoids structurally characterized by the presence of a 1-oxo-decahydro-3a,9-propanocyclopenta[8]annulene skeleton.
External Descriptors
Not available