| SpectraBase Compound ID | 2n27tVoTX96 |
|---|---|
| InChI | InChI=1S/C84H134O42/c1-11-80(7,109)18-12-13-34(25-85)68(107)110-31-42-53(97)56(100)66(125-75-67(124-73-60(104)54(98)51(95)41(26-86)117-73)61(105)63(33(2)116-75)121-71-62(106)64(40(90)30-113-71)122-69-57(101)48(92)37(87)27-111-69)76(119-42)126-77(108)84-22-21-78(3,4)23-36(84)35-14-15-45-81(8)19-17-47(79(5,6)44(81)16-20-82(45,9)83(35,10)24-46(84)91)120-72-59(103)55(99)52(96)43(118-72)32-115-74-65(50(94)39(89)29-114-74)123-70-58(102)49(93)38(88)28-112-70/h11,13-14,33,36-67,69-76,85-106,109H,1,12,15-32H2,2-10H3/b34-13-/t33-,36-,37+,38+,39-,40+,41+,42+,43+,44-,45+,46-,47-,48-,49-,50-,51-,52+,53+,54-,55-,56-,57+,58+,59+,60+,61+,62+,63-,64-,65+,66+,67+,69-,70-,71-,72-,73-,74-,75-,76-,80+,81-,82+,83+,84+/m0/s1 |
| InChIKey | AFLKYKNVPJFJBF-PPRHKGHLSA-N |
| Mol Weight | 1816.0 g/mol |
| Molecular Formula | C84H134O42 |
| Exact Mass | 1814.834968 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5c5uEgw5ksk |
|---|---|
| Name | GLEDISTSIDE_B;3-O-BETA-D-XYLOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSYL-28-O-BETA-D-XYLOPYRANOSYL-(1->3)-BETA-D-XYLOPYR |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C84H134O42 |
| InChI | InChI=1S/C84H134O42/c1-11-80(7,109)18-12-13-34(25-85)68(107)110-31-42-53(97)56(100)66(125-75-67(124-73-60(104)54(98)51(95)41(26-86)117-73)61(105)63(33(2)116-75)121-71-62(106)64(40(90)30-113-71)122-69-57(101)48(92)37(87)27-111-69)76(119-42)126-77(108)84-22-21-78(3,4)23-36(84)35-14-15-45-81(8)19-17-47(79(5,6)44(81)16-20-82(45,9)83(35,10)24-46(84)91)120-72-59(103)55(99)52(96)43(118-72)32-115-74-65(50(94)39(89)29-114-74)123-70-58(102)49(93)38(88)28-112-70/h11,13-14,33,36-67,69-76,85-106,109H,1,12,15-32H2,2-10H3/b34-13-/t33-,36-,37+,38+,39-,40+,41+,42+,43+,44-,45+,46-,47-,48-,49-,50-,51-,52+,53+,54-,55-,56-,57+,58+,59+,60+,61+,62+,63-,64-,65+,66+,67+,69-,70-,71-,72-,73-,74-,75-,76-,80+,81-,82+,83+,84+/m0/s1 |
| InChIKey | AFLKYKNVPJFJBF-PPRHKGHLSA-N |
| Literature Reference Author | R.W.TENG,W.NI,D.Z.WANG,J.K.DING,C.X.CHEN |
| Literature Reference Citation | MAGN.RES.CHEM.,40,609(2002) |
| Literature Reference DOI | 10.1002/mrc.1061 |
| Molecular Weight | 1815.963 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ23121 |