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CHEBI:69807 - Helioside C

ChEBI IDCHEBI:69807
ChEBI NameHelioside C
Stars
DefinitionA natural product found in Veronica lavaudiana.
Last Modified22 September 2014
DownloadsMolfile
FormulaC40H54O23
Net Charge0
Average Mass902.849
Monoisotopic Mass902.30559
SMILES[H]C1[C@@H](O)[C@@H](O)CO[C@@]1([H])O[C@H]1[C@H](OCCc2ccc(O)c(O)c2)O[C@H](CO[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](OC(=O)/C=C/c2ccc(O)c(OC)c2)[C@@H]1O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
WURCSWURCS=2.0/4,4,3/[a2122h-1b_1-5_1*OCC(CCCCCC$5/8)O(/7)O_4*OCC=^EC(CCCCCC$6/9)O(/8)OC/3=O][ad11h-1a_1-5][a2122h-1b_1-5][a212h-1b_1-5]/1-2-3-4/a2-b1_a3-c1_a6-d1
InChIInChI=1S/C40H54O23/c1-54-25-11-17(3-6-20(25)43)4-7-28(48)61-35-27(16-58-38-33(52)30(49)24(47)15-57-38)60-40(55-9-8-18-2-5-19(42)21(44)10-18)37(62-29-12-22(45)23(46)14-56-29)36(35)63-39-34(53)32(51)31(50)26(13-41)59-39/h2-7,10-11,22-24,26-27,29-47,49-53H,8-9,12-16H2,1H3/b7-4+/t22-,23+,24-,26-,27-,29+,30+,31-,32+,33-,34-,35-,36+,37-,38+,39+,40-/m1/s1
InChIKeyIPIDJIFORCRBPN-ODPUUKIVSA-N
Species of MetaboliteComponentSourceComments
Veronica lavaudiana (ncbitaxon:124267) - PubMed (21568305) MeOH extract of plant material
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)
Helioside C (CHEBI:69807) has role metabolite (CHEBI:25212)
Helioside C (CHEBI:69807) is a oligosaccharide (CHEBI:50699)
Citations