SpectraBase Compound ID | EMKIw42FwFL |
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InChI | InChI=1S/C42H62O20/c1-20(6-5-7-21(2)14-15-55-23-11-9-22-10-13-29(45)57-24(22)16-23)8-12-28(42(3,4)62-41-38(54)34(50)31(47)26(18-44)59-41)61-40-37(53)35(51)32(48)27(60-40)19-56-39-36(52)33(49)30(46)25(17-43)58-39/h6,9-11,13-14,16,25-28,30-41,43-44,46-54H,5,7-8,12,15,17-19H2,1-4H3/b20-6+,21-14+/t25-,26-,27-,28?,30-,31-,32-,33+,34+,35+,36-,37-,38-,39-,40+,41+/m1/s1 |
InChIKey | ISTYTNPHELVUES-ZCHRFIAVSA-N |
Mol Weight | 886.9 g/mol |
Molecular Formula | C42H62O20 |
Exact Mass | 886.383444 g/mol |
SpectraBase Spectrum ID | 9RSnX1bZUUU |
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Name | PERSICAOSIDE-D;10'-O-[BETA-GLUCOPYRANOSYL-(1->6)-BETA-GLUCOPYRANOSYL]-11'-O-BETA-GLUCOPYRANOSYL-KARATAVICINOL |
Compound Number | 4 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C42H62O20 |
InChI | InChI=1S/C42H62O20/c1-20(6-5-7-21(2)14-15-55-23-11-9-22-10-13-29(45)57-24(22)16-23)8-12-28(42(3,4)62-41-38(54)34(50)31(47)26(18-44)59-41)61-40-37(53)35(51)32(48)27(60-40)19-56-39-36(52)33(49)30(46)25(17-43)58-39/h6,9-11,13-14,16,25-28,30-41,43-44,46-54H,5,7-8,12,15,17-19H2,1-4H3/b20-6+,21-14+/t25-,26-,27-,28?,30-,31-,32-,33+,34+,35+,36-,37-,38-,39-,40+,41+/m1/s1 |
InChIKey | ISTYTNPHELVUES-ZCHRFIAVSA-N |
Literature Reference Author | M.IRANSHAHI,M.MOJARAB,H.SADEGHIAN,M.Y.HANAFI-BOJD,B.SCHNEIDE R |
Literature Reference Citation | PHYTOCHEM.,69,473(2008) |
Literature Reference DOI | 10.1016/j.phytochem.2007.08.001 |
Molecular Weight | 886.942 g/mol |
Sample ID | 44748 |
Solvent | CD3OD |