Compound Identification
SMILES
[H][C@@]1(CC[C@@]2(C)[C@]3([H])CC=C4[C@@]([H])(CC[C@H](O[C@@H]5O[C@H](CO[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@H](O)[C@H](O[C@@H]6OC[C@@H](O)[C@H](O)[C@@H]6O)[C@H]5O)C4(C)C)[C@]3(C)CC[C@]12C)[C@H](C)[C@H](O)[C@@H](O)[C@@H](O)C(C)(C)O
InChIKey
InChIKey=VBPXCWKMJJPMSZ-PURPTQTASA-N
Formula
C47H80O19
Mass
949.138
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
Triterpenoids Cucurbitacins Oligosaccharides Hydroxysteroids 14-alpha-methylsteroids Delta-5-steroids O-glycosyl compounds Oxanes Tertiary alcohols Secondary alcohols Polyols Oxacyclic compounds Acetals Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Cucurbitacin glycoside skeleton - Triterpenoid - Cucurbitacin skeleton - Oligosaccharide - 25-hydroxysteroid - 24-hydroxysteroid - 23-hydroxysteroid - 22-hydroxysteroid - 14-alpha-methylsteroid - Hydroxysteroid - Delta-5-steroid - O-glycosyl compound - Glycosyl compound - Oxane - Tertiary alcohol - Secondary alcohol - Oxacycle - Organoheterocyclic compound - Polyol - Acetal - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - 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