Compound Identification
SMILES
C[C@H]1C[C@@]2(C[C@H](C)[C@@H]3O[C@@H]4CC(O[C@@H]4C[C@@H]3O2)C(COC(C)=O)OC(C)=O)O[C@H]2C[C@]3(C[C@H]4O[C@H]5[C@H](C)[C@H]6OC(=O)C[C@H]7CC[C@@H]8OC9[C@H]%10O[C@@]%11(CC%10O[C@@H]9[C@@H](O%11)[C@H]8O7)CC[C@H]7CC(=O)[C@H](CC[C@H]8C[C@@H](C)C(=O)C(C[C@@H]6O[C@H]5C[C@H]4O3)O8)O7)O[C@@H]12
InChIKey
InChIKey=PXGXLFJJAPMXSL-CFJVCZLQSA-N
Formula
C63H86O23
Mass
1211.358
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
Fatty alcohol esters Tricarboxylic acids and derivatives Furopyrans Furofurans Ketals Fatty acid esters 1,4-dioxepanes 1,3-dioxepanes Pyrans Oxanes Monosaccharides Furanones Tetrahydrofurans Furans Lactones Ketones Carboxylic acid esters Oxacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Prostaglandin skeleton - Fatty alcohol ester - Tricarboxylic acid or derivatives - Furopyran - Furofuran - Ketal - Fatty acid ester - Dioxepane - 1,4-dioxepane - 1,3-dioxepane - Pyran - Oxane - Monosaccharide - 3-furanone - Tetrahydrofuran - Furan - Lactone - Ketone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Ether - Dialkyl ether - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aliphatic 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