Compound Identification
SMILES
Cl.Cl.CNCC1CCN(C1)C1=NC=NC2=C1N=CN2CCC(=O)N1CCN(CC(=O)O[C@@H]2C[C@@](C)(C=C)[C@@H](O)[C@H](C)[C@]34CCC(=O)[C@@H]3[C@@]2(C)[C@H](C)CC4)CC1
InChIKey
InChIKey=KVQHQZWPPOSKRW-ADYVOZLWSA-N
Formula
C40H62Cl2N8O5
Mass
805.89
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
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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
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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 - Mutilin derivatives
Direct Parent
Pleuromutilin and derivatives
Alternative Parents
Alpha amino acid esters 6-alkylaminopurines Dialkylarylamines N-alkylpiperazines Aminopyrimidines and derivatives N-substituted imidazoles Imidolactams Tertiary carboxylic acid amides Pyrrolidines Heteroaromatic compounds Trialkylamines Secondary alcohols Ketones Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Dialkylamines Organic oxides Hydrochlorides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pleuromutilin - Alpha-amino acid ester - 6-alkylaminopurine - 6-aminopurine - Alpha-amino acid or derivatives - Imidazopyrimidine - Purine - Dialkylarylamine - Aminopyrimidine - N-alkylpiperazine - 1,4-diazinane - N-substituted imidazole - Piperazine - Pyrimidine - Imidolactam - Imidazole - Azole - Tertiary carboxylic acid amide - Pyrrolidine - Heteroaromatic compound - Carboxylic acid ester - Tertiary amine - Carboxamide group - Ketone - Amino acid or derivatives - Secondary alcohol - Tertiary aliphatic amine - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Amine - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Alcohol - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Hydrochloride - Organopnictogen 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