Compound Identification
SMILES
CC1(C)[C@@H](O)[C@H](\C=C\C(O)CC2=CC3=CC=CC=C3S2)[C@@H](C\C=C/CCCC(=O)NCCO)C1=O
InChIKey
InChIKey=QVLDQALHAJMTPC-IDIARNOWSA-N
Formula
C28H37NO5S
Mass
499.67
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
- Subclass Eicosanoids
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Class
Fatty Acyls
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Fatty Acyls
Subclass
Eicosanoids
Intermediate Tree Nodes
Not available
Direct Parent
Prostaglandins and related compounds
Alternative Parents
1-benzothiophenes N-acylethanolamines N-acyl amines Cyclopentanols Beta-hydroxy ketones Benzenoids Thiophenes Heteroaromatic compounds Dihydrothiophenes Thioenol ethers Cyclic ketones Cyclic alcohols and derivatives Sulfenyl compounds Carboxylic acid amides Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Prostaglandin skeleton - 1-benzothiophene - Benzothiophene - N-acylethanolamine - Benzenoid - N-acyl-amine - Fatty amide - Cyclopentanol - Beta-hydroxy ketone - Heteroaromatic compound - Thiophene - 2,3-dihydrothiophene - Cyclic alcohol - Cyclic ketone - Thioenolether - Secondary alcohol - Ketone - Carboxamide group - Organoheterocyclic compound - Sulfenyl compound - Carboxylic acid derivative - Alkanolamine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as prostaglandins and related compounds. These are unsaturated carboxylic acids consisting of a 20 carbon skeleton that also contains a five member ring, and are based upon the fatty acid arachidonic acid.
External Descriptors
Not available