Compound Identification
SMILES
CC1OC(OC2CCC3(C=O)C4CCC5(C)C(CCC5(O)C4CCC3(O)C2)C2=CC(=O)OC2)C(O[N+]([O-])=O)C(O[N+]([O-])=O)C1O[N+]([O-])=O
InChIKey
InChIKey=PMKUTPDWPWYWCY-UHFFFAOYSA-N
Formula
C29H39N3O16
Mass
685.636
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
Steroid lactones
- Level 5 Cardenolides and derivatives
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Subclass
Steroid lactones
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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
Steroid lactones
Intermediate Tree Nodes
Cardenolides and derivatives
Direct Parent
Cardenolide glycosides and derivatives
Alternative Parents
Steroidal glycosides 19-oxosteroids 14-hydroxysteroids O-glycosyl compounds Oxanes Butenolides Monosaccharides Enoate esters Tertiary alcohols Alkyl nitrates Organic nitro compounds Organic nitric acids and derivatives Lactones Cyclic alcohols and derivatives Oxacyclic compounds Acetals Monocarboxylic acids and derivatives Hydrocarbon derivatives Aldehydes Organic nitrogen compounds Organic oxides Organic zwitterions
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Cardanolide-glycoside - Steroidal glycoside - 19-oxosteroid - Oxosteroid - 14-hydroxysteroid - 5-hydroxysteroid - Hydroxysteroid - Glycosyl compound - O-glycosyl compound - Oxane - 2-furanone - Monosaccharide - Alkyl nitrate - Dihydrofuran - Tertiary alcohol - Cyclic alcohol - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Organic nitrate - Carboxylic acid ester - Organic nitro compound - Lactone - Organic nitric acid or derivatives - Monocarboxylic acid or derivatives - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Acetal - Organooxygen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Carbonyl group - Organic nitrogen compound - Aldehyde - Organic zwitterion - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cardenolide glycosides and derivatives. These are compounds containing a carbohydrate glycosidically bound to the cardenolide moiety.
External Descriptors
Not available