Compound Identification
SMILES
CC[C@@]1(OC)O[C@@H]2[C@@]3(O1)[C@@H](OC(=O)[C@@]1(C)O[C@@H]1C)[C@@]1(C)C[C@@]3(OC(C)=O)[C@@](C)([C@H]1CC(=O)OC)[C@]13OC4(C)O[C@](CC(=O)OC)([C@@]21O4)[C@@](C)(C[C@H]3O)[C@@H](OC(C)=O)C1=COC=C1
InChIKey
InChIKey=CKUCEZICWTXPGZ-DXRSEUPWSA-N
Formula
C43H56O19
Mass
876.902
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
Pentacarboxylic acids and derivatives Diterpenoids Carboxylic acid orthoesters Ortho esters 1,3-dioxanes Oxirane carboxylic acids 1,3-dioxolanes Furans Heteroaromatic compounds Methyl esters Cyclic alcohols and derivatives Secondary alcohols Dialkyl ethers Oxacyclic compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Prostaglandin skeleton - Diterpenoid - Pentacarboxylic acid or derivatives - Carboxylic acid orthoester - Ortho ester - Meta-dioxane - Oxirane carboxylic acid or derivatives - Oxirane carboxylic acid - Meta-dioxolane - Heteroaromatic compound - Cyclic alcohol - Methyl ester - Furan - Carboxylic acid ester - Secondary alcohol - Orthocarboxylic acid derivative - Ether - Oxirane - Organoheterocyclic compound - Dialkyl ether - Oxacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Organooxygen 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