Compound Identification
SMILES
CC(=O)OC(C)(C)C=CC(=O)C(C)(OP(O)(O)=O)C1C(O)CC2(C)C3CC=C4C(C=C(O)C(=O)C4(C)C)C3(C)C(=O)CC12C
InChIKey
InChIKey=TZCITXUVIOTJKJ-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 Monoalkyl phosphates Cyclohexenones Enones Acryloyl compounds Secondary alcohols Cyclic alcohols and derivatives Carboxylic acid esters Monocarboxylic acids and derivatives Enols Hydrocarbon derivatives Organic oxides
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Cucurbitacin skeleton - Triterpenoid - 22-oxosteroid - 21-oxosteroid - Steroid ester - 11-oxosteroid - 3-oxo-delta-1-steroid - 3-oxosteroid - Oxosteroid - Hydroxysteroid - 16-hydroxysteroid - 2-hydroxysteroid - Delta-1-steroid - Cyclohexenone - Monoalkyl phosphate - Phosphoric acid ester - Alkyl phosphate - Organic phosphoric acid derivative - Acryloyl-group - Cyclic alcohol - Alpha,beta-unsaturated ketone - Enone - Cyclic ketone - Carboxylic acid ester - Secondary alcohol - Ketone - Enol - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Alcohol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - 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