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CHEBI:183042 - Furcogenin 3-[2''-glucosyl-6''-arabinosylglucoside]

ChEBI IDCHEBI:183042
ChEBI NameFurcogenin 3-[2''-glucosyl-6''-arabinosylglucoside]
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC44H70O18
Net Charge0
Average Mass887.026
Monoisotopic Mass886.45622
SMILESCC1CCC2(OC1)OC1CC3C4CCC5CC(OC6OC(COC7OCC(O)C(O)C7O)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)CCC5(C)C4CC(=O)C3(C)C1C2C
InChIInChI=1S/C44H70O18/c1-18-7-10-44(57-15-18)19(2)30-26(62-44)12-24-22-6-5-20-11-21(8-9-42(20,3)23(22)13-29(47)43(24,30)4)58-41-38(61-40-37(54)34(51)32(49)27(14-45)59-40)35(52)33(50)28(60-41)17-56-39-36(53)31(48)25(46)16-55-39/h18-28,30-41,45-46,48-54H,5-17H2,1-4H3
InChIKeyJNPONVQKBRADJJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) Esophagus (BTO:0000959) MetaboLights (MTBLS3014)
Roles Classification
Biological Role:
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)
Furcogenin 3-[2''-glucosyl-6''-arabinosylglucoside] (CHEBI:183042) is a steroid saponin (CHEBI:61655)
IUPAC Name 
16-[4,5-dihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxan-2-yl]oxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-10-one
Manual XrefsDatabases
HMDB0034343HMDB