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CHEBI:134508 - asparagoside F

Default Structure
ChEBI IDCHEBI:134508
ChEBI Nameasparagoside F
Stars
DefinitionA spirostanyl glycoside that is sarsasapogenin in which the hydroxy hydrogen at position 3 has been replaced by a β-D-glucopyranosyl-(1→3)-[β-D-xylopyranosyl-(1→4)-β-D-glucopyranosyl-(1→4)]-β-D-glucopyranosyl moiety. It is isolated from Asparagus officinalis.
Last Modified6 July 2017
SubmitterKeeva
DownloadsMolfile
FormulaC50H82O22
Net Charge0
Average Mass1035.184
Monoisotopic Mass1034.52977
SMILES[H][C@]12CC[C@]3([H])[C@]([H])(CC[C@@]4(C)[C@@]3([H])C[C@]3([H])O[C@]5(CC[C@H](C)CO5)[C@@H](C)[C@]43[H])[C@@]1(C)CC[C@H](O[C@@H]1O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]1O)C2
InChIInChI=1S/C50H82O22/c1-20-7-12-50(64-18-20)21(2)32-28(72-50)14-26-24-6-5-22-13-23(8-10-48(22,3)25(24)9-11-49(26,32)4)65-47-40(62)43(71-45-38(60)35(57)34(56)29(15-51)66-45)42(31(17-53)68-47)70-46-39(61)36(58)41(30(16-52)67-46)69-44-37(59)33(55)27(54)19-63-44/h20-47,51-62H,5-19H2,1-4H3/t20-,21-,22+,23-,24+,25-,26-,27+,28-,29+,30+,31+,32-,33-,34+,35-,36+,37+,38+,39+,40+,41+,42+,43+,44-,45-,46-,47+,48-,49-,50+/m0/s1
InChIKeyJGMVGSROWHLFSW-QDHKAWJGSA-N
Species of MetaboliteComponentSourceComments
Asparagus officinalis (ncbitaxon:4686) - DOI (10.1007/BF00565519)
Mus musculus (ncbitaxon:10090) - MetaboLights (MTBLS313)
Rattus norvegicus (ncbitaxon:10116) - MetaboLights (MTBLS313)
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
rat metabolite  Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus).
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
asparagoside F (CHEBI:134508) has functional parent (25S)-5β-spirostan-3β-ol (CHEBI:15578)
asparagoside F (CHEBI:134508) has role mouse metabolite (CHEBI:75771)
asparagoside F (CHEBI:134508) has role plant metabolite (CHEBI:76924)
asparagoside F (CHEBI:134508) has role rat metabolite (CHEBI:86264)
asparagoside F (CHEBI:134508) is a cyclic ketal (CHEBI:59779)
asparagoside F (CHEBI:134508) is a spirostanyl glycoside (CHEBI:38091)
asparagoside F (CHEBI:134508) is a tetrasaccharide derivative (CHEBI:63567)
IUPAC Name 
(25S)-5β-spirostan-3β-yl β-D-glucopyranosyl-(1→3)-[β-D-xylopyranosyl-(1→4)-β-D-glucopyranosyl-(1→4)]-β-D-glucopyranoside
Synonym  Source
sarsasapogenin 3-O-{β-D-glucopyranosyl-(1→3)-[β-D-xylopyranosyl-(1→4)-β-D-glucopyranosyl-(1→4)]-β-D-glucopyranoside}ChEBI
Manual XrefsDatabases
HMDB0029321HMDB