Compound Identification
SMILES
C[C@@H]1CC[C@@]23CCC(=O)[C@@H]2[C@]1(C)[C@@H](C[C@@](C)(C=C)[C@@H](O)[C@@H]3C)OC(=O)CSC1CCN(CC1)C(=O)CCN1C=NC2=C1N=C(N)N=C2N1CCC(CC1)N(C)C
InChIKey
InChIKey=XEZHOXDPHUIUDP-WWCRHKDRSA-N
Formula
C42H64N8O5S
Mass
793.09
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
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Level 6
Mutilin derivatives
- Level 7 Pleuromutilin and derivatives
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Level 6
Mutilin derivatives
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Level 5
Mutilane diterpenoids
-
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 - Mutilin derivatives
Direct Parent
Pleuromutilin and derivatives
Alternative Parents
6-alkylaminopurines N-acylpiperidines Dialkylarylamines Aminopiperidines Aminopyrimidines and derivatives Imidolactams N-substituted imidazoles Tertiary carboxylic acid amides Heteroaromatic compounds Trialkylamines Amino acids and derivatives Secondary alcohols Carboxylic acid esters Ketones Dialkylthioethers Sulfenyl compounds Azacyclic compounds Monocarboxylic acids and derivatives Primary amines Organopnictogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pleuromutilin - 6-alkylaminopurine - 6-aminopurine - Purine - Imidazopyrimidine - N-acyl-piperidine - Dialkylarylamine - 4-aminopiperidine - Aminopyrimidine - Pyrimidine - Piperidine - N-substituted imidazole - Imidolactam - Tertiary carboxylic acid amide - Heteroaromatic compound - Azole - Imidazole - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Ketone - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Thioether - Sulfenyl compound - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Dialkylthioether - Hydrocarbon derivative - Amine - Alcohol - Carbonyl group - Organic oxide - Primary amine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organosulfur compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pleuromutilin and derivatives. These are mutilins with a hydroxyacetate derivative attached to the C8 carbon atom of the cyclopenta[8]annulene moiety.
External Descriptors
Not available