CHEBI:69118 - withalongolide N

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ChEBI Name withalongolide N
ChEBI ID CHEBI:69118
Definition A steroid saponin that is the monosaccharide derivative of the 19-norwithanolide. It has been isolated from the aerial parts of Physalis longifolia.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C33H48O10
Net Charge 0
Average Mass 604.72820
Monoisotopic Mass 604.32475
InChI InChI=1S/C33H48O10/c1-15-17(14-41-32-30(39)29(38)28(37)27(13-34)43-32)10-26(42-31(15)40)16(2)23-6-7-24-21-12-25(36)22-11-18(35)4-5-19(22)20(21)8-9-33(23,24)3/h16,18,20-21,23-24,26-30,32,34-35,37-39H,4-14H2,1-3H3/t16-,18+,20+,21+,23+,24-,26+,27+,28+,29-,30+,32+,33+/m0/s1
InChIKey GCUKFNAJZUUBSQ-HCGFFNIQSA-N
SMILES C[C@@H]([C@H]1CC[C@H]2[C@@H]3CC(=O)C4=C(CC[C@@H](O)C4)[C@H]3CC[C@]12C)[C@H]1CC(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=C(C)C(=O)O1
Metabolite of Species Details
Physalis longifolia (NCBI:txid161495) Found in aerial part (BTO:0001658). CH2Cl2-MeOH(1:1) extract of the air-dried aerial parts See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via saponin )
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing withalongolide N (CHEBI:69118) has role metabolite (CHEBI:25212)
withalongolide N (CHEBI:69118) has role plant metabolite (CHEBI:76924)
withalongolide N (CHEBI:69118) is a β-D-glucoside (CHEBI:22798)
withalongolide N (CHEBI:69118) is a δ-lactone (CHEBI:18946)
withalongolide N (CHEBI:69118) is a 3α-hydroxy steroid (CHEBI:36835)
withalongolide N (CHEBI:69118) is a monosaccharide derivative (CHEBI:63367)
withalongolide N (CHEBI:69118) is a steroid saponin (CHEBI:61655)
IUPAC Name
[(2R)-2-{(1S)-1-[(3α,17β)-3-hydroxy-6-oxoestr-5(10)-en-17-yl]ethyl}-5-methyl-6-oxo-3,6-dihydro-2H-pyran-4-yl]methyl β-D-glucopyranoside
Synonym Source
28-O-β-D-glucopyranosyl-3α-hydroxy-6-oxo-19-norwitha-5(10),24-dienolide ChEBI
Registry Number Type Source
22217718 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
22098611 PubMed citation Europe PMC
Last Modified
21 November 2013