asparagoside F (CHEBI:134508)

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:134508 - asparagoside F

ChEBI ID	CHEBI:134508
ChEBI Name	asparagoside F
Stars
Definition	A spirostanyl glycoside that is sarsasapogenin in which the hydroxy hydrogen at position 3 has been replaced by a β-D-glucopyranosyl-(1→3)-[β-D-xylopyranosyl-(1→4)-β-D-glucopyranosyl-(1→4)]-β-D-glucopyranosyl moiety.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 Modified	6 July 2017
Submitter	Keeva
Downloads	Molfile

Formula	C50H82O22
Net Charge	0
Average Mass	1035.184
Monoisotopic Mass	1034.52977
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
InChI	InChI=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
InChIKey	JGMVGSROWHLFSW-QDHKAWJGSA-N

Species of Metabolite	Component	Source
Mus musculus (ncbitaxon:10090)	-	MetaboLights (MTBLS313)
Rattus norvegicus (ncbitaxon:10116)	-	MetaboLights (MTBLS313)
Asparagus officinalis (ncbitaxon:4686)	-	DOI (10.1007/BF00565519)

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.

rat metabolite Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus).

mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).

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 Xrefs	Databases
HMDB0029321	HMDB