SpectraBase Compound ID | 5bD5By22UIn |
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InChI | InChI=1S/C42H46O23/c1-15-28(49)34(55)39(42(59-15)64-38-31(52)27-22(47)11-18(44)12-23(27)61-37(38)17-5-8-20(45)21(46)10-17)65-41-36(57)33(54)30(51)25(63-41)14-58-26(48)9-4-16-2-6-19(7-3-16)60-40-35(56)32(53)29(50)24(13-43)62-40/h2-12,15,24-25,28-30,32-36,39-47,49-51,53-57H,13-14H2,1H3/b9-4+/t15-,24+,25+,28-,29+,30+,32-,33-,34+,35+,36+,39+,40+,41-,42-/m0/s1 |
InChIKey | SENXSEXWQKRDKG-XJRUTDMXSA-N |
Mol Weight | 918.8 g/mol |
Molecular Formula | C42H46O23 |
Exact Mass | 918.242988 g/mol |
SpectraBase Spectrum ID | HHBdHG76cAK |
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Name | QUERCETIN-3-O-[2''-O-6'''-O-[PARA-(7''''-O-BETA-D-GLUCOPYRANOSYL)-COUMAROYL]-BETA-D-GLUCOPYRANOSYL]-ALPHA-L-RHAMNOPYRANOSIDE |
Compound Number | 4 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C42H46O23 |
InChI | InChI=1S/C42H46O23/c1-15-28(49)34(55)39(42(59-15)64-38-31(52)27-22(47)11-18(44)12-23(27)61-37(38)17-5-8-20(45)21(46)10-17)65-41-36(57)33(54)30(51)25(63-41)14-58-26(48)9-4-16-2-6-19(7-3-16)60-40-35(56)32(53)29(50)24(13-43)62-40/h2-12,15,24-25,28-30,32-36,39-47,49-51,53-57H,13-14H2,1H3/b9-4+/t15-,24+,25+,28-,29+,30+,32-,33-,34+,35+,36+,39+,40+,41-,42-/m0/s1 |
InChIKey | SENXSEXWQKRDKG-XJRUTDMXSA-N |
Literature Reference Author | A.HASLER,G.A.GROSS,B.MEIER,O.STICHER |
Literature Reference Citation | PHYTOCHEM.,31,1391(1992) |
Literature Reference DOI | 10.1016/0031-9422(92)80298-S |
Molecular Weight | 918.813 g/mol |
Solvent | CD3OD |
Source File Reference | UWVN5240 |