Compound Identification
SMILES
C[C@@H]([C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)O[C@@H]1O[C@H](COCC2=CC=CC=C2)[C@@H](OCC2=CC=CC=C2)[C@H](OCC2=CC=CC=C2)[C@H]1O[C@@H]1O[C@@H](C)[C@H](OCC2=CC=CC=C2)[C@@H](OCC2=CC=CC=C2)[C@H]1OCC1=CC=CC=C1)[C@H]1CCC(C)C(=O)O1
InChIKey
InChIKey=FUCHHDXYUUHTEV-VCASNPLISA-N
Formula
C81H98O12
Mass
1263.663
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
-
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 Delta-5-steroids Diterpenoids Disaccharides O-glycosyl compounds Benzylethers Delta valerolactones Oxanes Carboxylic acid esters Oxacyclic compounds Acetals Dialkyl ethers Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Withanolide-glycoside - Diterpene glycoside - Steroidal glycoside - Diterpene lactone - Diterpenoid - Delta-5-steroid - Terpene glycoside - Disaccharide - Glycosyl compound - O-glycosyl compound - Benzylether - Delta_valerolactone - Delta valerolactone - Benzenoid - Monocyclic benzene moiety - Oxane - Lactone - Carboxylic acid ester - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Ether - Oxacycle - Dialkyl ether - Acetal - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic 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