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CHEBI:55467 - dalpatein β-D-apiofuranosyl-(1→6)-β-D-glucopyranoside

ChEBI IDCHEBI:55467
ChEBI Namedalpatein β-D-apiofuranosyl-(1→6)-β-D-glucopyranoside
Stars
ASCII Namedalpatein beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside
DefinitionA 7-[β-D-apiofuranosyl-(1→6)-β-D-glucopyranosyloxy]isoflavone having methoxy substituents at the 6- and 2'-positions and a methylenedioxy moiety at the 4'- and 5'-positions.
Last Modified21 January 2015
SubmitterSteve
DownloadsMolfile
FormulaC29H32O16
Net Charge0
Average Mass636.559
Monoisotopic Mass636.16903
SMILESCOc1cc2c(=O)c(-c3cc4c(cc3OC)OCO4)coc2cc1O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C29H32O16/c1-37-15-5-19-18(42-11-43-19)3-12(15)14-7-39-16-6-20(17(38-2)4-13(16)22(14)31)44-27-25(34)24(33)23(32)21(45-27)8-40-28-26(35)29(36,9-30)10-41-28/h3-7,21,23-28,30,32-36H,8-11H2,1-2H3/t21-,23-,24+,25-,26+,27-,28-,29-/m1/s1
InChIKeyKAZTVTFKDLJVBH-PNJBZCJOSA-N
ChEBI Ontology
Outgoing Relation(s)
dalpatein β-D-apiofuranosyl-(1→6)-β-D-glucopyranoside (CHEBI:55467) is a 7-[β-D-apiofuranosyl-(1→6)-β-D-glucopyranosyloxy]isoflavone (CHEBI:55464)
dalpatein β-D-apiofuranosyl-(1→6)-β-D-glucopyranoside (CHEBI:55467) is a benzodioxoles (CHEBI:38298)
IUPAC Names 
6-methoxy-3-(6-methoxy-1,3-benzodioxol-5-yl)-4-oxo-4H-chromen-7-yl 2-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl]-β-D-glucopyranoside
6-methoxy-3-(6-methoxy-1,3-benzodioxol-5-yl)-4-oxo-4H-chromen-7-yl 3-C-(hydroxymethyl)-β-D-glycero-tetrofuranosyl-(1→2)-β-D-glucopyranoside
UniProt Name  Source
dalpatein β-D-apiofuranosyl-(1→6)-β-D-glucopyranosideUniProt