Compound Identification
SMILES
CC1=C(C)C(=O)O[C@H](C1)[C@]1(C)O[C@@]23CC[C@@H]1[C@@]2(C)CC[C@H]1[C@H]3CC=C2C[C@H](CC(=O)[C@]12C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIKey
InChIKey=BAHPTJNBOPDDGX-JGVQJFIVSA-N
Formula
C34H48O10
Mass
616.748
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 Withanolides and derivatives
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Subclass
Steroid lactones
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Class
Steroids and steroid derivatives
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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
Withanolides and derivatives
Direct Parent
Withanolide glycosides and derivatives
Alternative Parents
Diterpene glycosides Steroidal glycosides Diterpene lactones Oxosteroids Diterpenoids Naphthofurans O-glycosyl compounds Dihydropyranones Monosaccharides Oxanes Enoate esters Oxolanes Lactones Ketones Secondary alcohols Acetals Monocarboxylic acids and derivatives Polyols Dialkyl ethers Oxacyclic compounds Aldehydes Hydrocarbon derivatives Primary alcohols Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Withanolide-glycoside - Diterpene glycoside - Steroidal glycoside - Diterpene lactone - Diterpenoid - 1-oxosteroid - Oxosteroid - Terpene glycoside - Naphthofuran - Glycosyl compound - O-glycosyl compound - Dihydropyranone - Pyran - Monosaccharide - Oxane - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Oxolane - Secondary alcohol - Carboxylic acid ester - Ketone - Lactone - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Polyol - Ether - Acetal - Monocarboxylic acid or derivatives - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Primary alcohol - Aldehyde - Alcohol - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as withanolide glycosides and derivatives. These are withanolides in which at least one hydroxyl group is glycosylated.
External Descriptors
Not available