Compound Identification
SMILES
CO[C@H]1C=C2[C@@H](CC[C@H](OC3OCC(OC(C)=O)C(O)C3O)C2(C)C)[C@]2(C)CC[C@]3(C)C([C@H](C)CCC=C(C)C)[C@H](C[C@@]3(C)[C@H]12)OC1OC(COC(C)=O)C(O)C(O)C1O
InChIKey
InChIKey=AMBFYXVSRGPNHQ-VWZVTDCKSA-N
Formula
C46H74O14
Mass
851.084
Taxonomic Classification
Taxonomy Tree
-
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
Triterpenoids Cucurbitacins 14-alpha-methylsteroids Delta-5-steroids O-glycosyl compounds Oxanes Monosaccharides Dicarboxylic acids and derivatives Secondary alcohols Carboxylic acid esters Polyols Acetals Oxacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Cucurbitacin glycoside skeleton - Cucurbitacin skeleton - Triterpenoid - 14-alpha-methylsteroid - Delta-5-steroid - Glycosyl compound - O-glycosyl compound - Dicarboxylic acid or derivatives - Monosaccharide - Oxane - Carboxylic acid ester - Secondary alcohol - Ether - Organoheterocyclic compound - Dialkyl ether - Oxacycle - Acetal - Carboxylic acid derivative - Polyol - Hydrocarbon derivative - Alcohol - Organic oxygen compound - Organic oxide - Carbonyl group - Organooxygen compound - 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