Compound Identification
SMILES
COC(C)(C)[C@@H]1CC(=O)[C@](C)(O)[C@H]2[C@@H](C[C@@]3(C)[C@@H]4CC=C5[C@@H](C=C(O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(=O)C5(C)C)[C@]4(C)C(=O)C[C@]23C)O1
InChIKey
InChIKey=IEGSGKOVOHXXNB-APTWSYTCSA-N
Formula
C37H54O12
Mass
690.827
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Steroids and steroid derivatives
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Subclass
Steroidal glycosides
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Level 5
Steroidal saponins
- Level 6 Cucurbitacin glycosides
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Level 5
Steroidal saponins
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Subclass
Steroidal glycosides
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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
Steroidal glycosides
Intermediate Tree Nodes
Steroidal saponins
Direct Parent
Cucurbitacin glycosides
Alternative Parents
Diterpene glycosides 11-oxosteroids 14-alpha-methylsteroids 3-oxo delta-1-steroids Hydroxysteroids Delta-1-steroids Diterpenoids Hexoses O-glycosyl compounds Oxepanes Cyclohexenones Oxanes Acyloins Tertiary alcohols Secondary alcohols Polyols Oxacyclic compounds Acetals Dialkyl ethers Organic oxides Aldehydes Hydrocarbon derivatives Primary alcohols
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Cucurbitacin glycoside skeleton - Diterpene glycoside - 20-hydroxysteroid - Diterpenoid - 11-oxosteroid - Oxosteroid - Hydroxysteroid - 3-oxo-delta-1-steroid - 3-oxosteroid - 14-alpha-methylsteroid - Terpene glycoside - Delta-1-steroid - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Cyclohexenone - Oxepane - Acyloin - Monosaccharide - Oxane - Tertiary alcohol - Ketone - Cyclic ketone - Secondary alcohol - Acetal - Oxacycle - Dialkyl ether - Organoheterocyclic compound - Polyol - Ether - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organic oxide - Organic oxygen compound - Alcohol - Aldehyde - 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