Compound Identification
SMILES
C[C@@]12OC(=O)[C@]3(O)CC[C@H]4[C@@H](C[C@@H](O)[C@@]5(O)CC=CC(=O)[C@]45C)[C@]45O[C@@]13[C@@H](C4=O)[C@]1(C)C[C@H]2OC(=O)[C@@H]1CO5
InChIKey
InChIKey=DUGJJSWZRHBJJK-IGRMCQLTSA-N
Formula
C28H32O11
Mass
544.553
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Physalins and derivatives
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Class
Steroids and steroid derivatives
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Steroids and steroid derivatives
Subclass
Physalins and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Physalins and derivatives
Alternative Parents
Cyclohexenones Delta valerolactones Ketals Oxepanes Oxanes Gamma butyrolactones Furanones Dicarboxylic acids and derivatives Tertiary alcohols Tetrahydrofurans Cyclic alcohols and derivatives Carboxylic acid esters Secondary alcohols Oxacyclic compounds Polyols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Physalin skeleton - Delta valerolactone - Ketal - Cyclohexenone - Delta_valerolactone - Oxepane - Dicarboxylic acid or derivatives - 3-furanone - Gamma butyrolactone - Oxane - Cyclic alcohol - Tetrahydrofuran - Tertiary alcohol - Lactone - Ketone - Carboxylic acid ester - Secondary alcohol - Organoheterocyclic compound - Oxacycle - Acetal - Carboxylic acid derivative - Polyol - Alcohol - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as physalins and derivatives. These are steroidal constituents of Physalis plants which possess an unusual 13,14-seco-16,24-cyclo-steroidal ring skeleton (where the bond that is normally present between the 13 and 14 positions in other steroids is broken while a new bond between positions 16 and 24 is formed).
External Descriptors
Not available