CHEBI:69115 - withalongolide K

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ChEBI Name withalongolide K
ChEBI ID CHEBI:69115
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 C33H46O10
Net Charge 0
Average Mass 602.71230
Monoisotopic Mass 602.30910
InChI InChI=1S/C33H46O10/c1-15-17(14-41-32-30(39)29(38)28(37)26(13-34)43-32)11-25(42-31(15)40)16(2)21-7-8-22-20-12-24(36)19-5-4-6-23(35)27(19)18(20)9-10-33(21,22)3/h4-6,16,18,20-22,24-26,28-30,32,34-39H,7-14H2,1-3H3/t16-,18-,20+,21+,22-,24-,25+,26+,28+,29-,30+,32+,33+/m0/s1
InChIKey QYYMGJGFQVRKJA-RMHZGSCISA-N
SMILES C[C@@H]([C@H]1CC[C@H]2[C@@H]3C[C@H](O)c4cccc(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): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via saponin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing withalongolide K (CHEBI:69115) has role metabolite (CHEBI:25212)
withalongolide K (CHEBI:69115) has role plant metabolite (CHEBI:76924)
withalongolide K (CHEBI:69115) is a β-D-glucoside (CHEBI:22798)
withalongolide K (CHEBI:69115) is a δ-lactone (CHEBI:18946)
withalongolide K (CHEBI:69115) is a 1-hydroxy steroid (CHEBI:71017)
withalongolide K (CHEBI:69115) is a 6α-hydroxy steroid (CHEBI:36850)
withalongolide K (CHEBI:69115) is a monosaccharide derivative (CHEBI:63367)
withalongolide K (CHEBI:69115) is a steroid saponin (CHEBI:61655)
IUPAC Name
[(2R)-2-{(1S)-1-[(6α,17β)-1,6-dihydroxyestra-1,3,5(10)-trien-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-1,6α-dihydroxy-19-norwitha-1,3,5(10),24-tetraenolide ChEBI
Registry Number Type Source
22217717 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
22098611 PubMed citation Europe PMC
Last Modified
20 November 2013