Compound Identification
SMILES
CC(=O)OC(C)(C)C=CC(=O)C(C)(O)C1C(O)CC2(C)C3CC=C4C(C=C(OP(O)(O)=O)C(=O)C4(C)C)C3(C)C(=O)CC12C
InChIKey
InChIKey=JLGJUMDAQAJSMV-UHFFFAOYSA-N
Formula
C32H45O11P
Mass
636.675
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Cucurbitacins
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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
Cucurbitacins
Intermediate Tree Nodes
Not available
Direct Parent
Cucurbitacins
Alternative Parents
Triterpenoids Steroid esters 11-oxosteroids 16-hydroxysteroids 3-oxo delta-1-steroids Delta-1-steroids Cyclohexenones Phosphate esters Acyloins Alpha-hydroxy ketones Acryloyl compounds Tertiary alcohols Enones Cyclic alcohols and derivatives Carboxylic acid esters Secondary alcohols Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Triterpenoid - Cucurbitacin skeleton - 22-oxosteroid - 21-oxosteroid - Steroid ester - 20-hydroxysteroid - 16-hydroxysteroid - 11-oxosteroid - Hydroxysteroid - Oxosteroid - 3-oxosteroid - 3-oxo-delta-1-steroid - Delta-1-steroid - Cyclohexenone - Organic phosphoric acid derivative - Phosphoric acid ester - Acyloin - Acryloyl-group - Alpha-hydroxy ketone - Alpha,beta-unsaturated ketone - Cyclic alcohol - Enone - Tertiary alcohol - Cyclic ketone - Carboxylic acid ester - Secondary alcohol - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Alcohol - Organooxygen compound - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as cucurbitacins. These are polycyclic compounds containing the tetracyclic cucurbitane nucleus skeleton, 19-(10->9b)-abeo-10alanost-5-ene (also known as 9b-methyl-19-nor lanosta-5-ene), with a variety of oxygenation functionalities at different positions.
External Descriptors
Not available