Compound Identification
SMILES
CC(C)=C[C@H]1C[C@](C)(O)C2C(C[C@@]3(C)[C@@H]4CC=C5[C@@H](CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C5(C)C)[C@]4(C)C(=O)C[C@]23C)O1
InChIKey
InChIKey=LQQSJEUPEQMGKJ-YHDOTQFQSA-N
Formula
C36H56O9
Mass
632.835
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
-
Subclass
Steroidal glycosides
-
Level 5
Steroidal saponins
- Level 6 Cucurbitacin glycosides
-
Level 5
Steroidal saponins
-
Subclass
Steroidal glycosides
-
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
Steroidal glycosides
Intermediate Tree Nodes
Steroidal saponins
Direct Parent
Cucurbitacin glycosides
Alternative Parents
Diterpene glycosides 11-oxosteroids 14-alpha-methylsteroids Hydroxysteroids Delta-5-steroids Diterpenoids Hexoses O-glycosyl compounds Oxanes Tertiary alcohols Secondary alcohols Ketones Oxacyclic compounds Polyols Dialkyl ethers Acetals Organic oxides Hydrocarbon derivatives Primary alcohols Aldehydes
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Cucurbitacin glycoside skeleton - Diterpene glycoside - 20-hydroxysteroid - Diterpenoid - 14-alpha-methylsteroid - Hydroxysteroid - Oxosteroid - 11-oxosteroid - Delta-5-steroid - Terpene glycoside - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Monosaccharide - Oxane - Tertiary alcohol - Secondary alcohol - Ketone - Dialkyl ether - Oxacycle - Ether - Organoheterocyclic compound - Polyol - Acetal - Hydrocarbon derivative - Alcohol - Organic oxide - Organooxygen compound - Aldehyde - Carbonyl group - Organic oxygen compound - Primary alcohol - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cucurbitacin glycosides. These are polycyclic compounds containing a carbohydrate derivative glycosidically linked to a curcubitane nucleus.
External Descriptors
Not available