Compound Identification
SMILES
[2H]O[C@@]1([2H])[C@]([2H])(C([2H])([2H])[2H])C23C([2H])([2H])C([2H])([2H])C(=O)C2([2H])C(C([2H])([2H])[2H])(C([2H])(C([2H])([2H])[2H])C([2H])([2H])C3([2H])[2H])[C@]([2H])(OC(=O)C([2H])([2H])SC2([2H])C([2H])([2H])[C@]3([2H])N(C([2H])([2H])[2H])[C@]([2H])(C([2H])([2H])C3([2H])[2H])C2([2H])[2H])C([2H])([2H])[C@]1(C([2H])=C([2H])[2H])C([2H])([2H])[2H]
InChIKey
InChIKey=STZYTFJPGGDRJD-GICUJCNUSA-N
Formula
C30H47NO4S
Mass
565.06
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
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
Tropane alkaloids N-alkylpyrrolidines Piperidines Amino acids and derivatives Carboxylic acid esters Cyclic alcohols and derivatives Ketones Trialkylamines Secondary alcohols Azacyclic compounds Monocarboxylic acids and derivatives Dialkylthioethers Sulfenyl compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Pleuromutilin - Tropane alkaloid - Piperidine - N-alkylpyrrolidine - Cyclic alcohol - Pyrrolidine - Amino acid or derivatives - Carboxylic acid ester - Ketone - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkylthioether - Monocarboxylic acid or derivatives - Sulfenyl compound - Thioether - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxide - Alcohol - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Amine - Organopnictogen compound - Hydrocarbon derivative - Aliphatic 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