SpectraBase Compound ID | D709IU1IK8P |
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InChI | InChI=1S/C84H134O41/c1-12-80(8,108)19-13-14-33(2)68(106)109-31-42-53(96)56(99)66(124-75-67(123-73-60(103)54(97)51(94)41(26-85)116-73)61(104)63(34(3)115-75)120-71-62(105)64(40(89)30-112-71)121-69-57(100)48(91)37(86)27-110-69)76(118-42)125-77(107)84-23-22-78(4,5)24-36(84)35-15-16-45-81(9)20-18-47(79(6,7)44(81)17-21-82(45,10)83(35,11)25-46(84)90)119-72-59(102)55(98)52(95)43(117-72)32-114-74-65(50(93)39(88)29-113-74)122-70-58(101)49(92)38(87)28-111-70/h12,14-15,34,36-67,69-76,85-105,108H,1,13,16-32H2,2-11H3/b33-14-/t34-,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 | AEPZIZXGVQDNGR-YLZODVGFSA-N |
Mol Weight | 1800.0 g/mol |
Molecular Formula | C84H134O41 |
Exact Mass | 1798.840054 g/mol |
SpectraBase Spectrum ID | K8YYYUwquxk |
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Name | GLEDISTSIDE_A;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 | 1 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C84H134O41 |
InChI | InChI=1S/C84H134O41/c1-12-80(8,108)19-13-14-33(2)68(106)109-31-42-53(96)56(99)66(124-75-67(123-73-60(103)54(97)51(94)41(26-85)116-73)61(104)63(34(3)115-75)120-71-62(105)64(40(89)30-112-71)121-69-57(100)48(91)37(86)27-110-69)76(118-42)125-77(107)84-23-22-78(4,5)24-36(84)35-15-16-45-81(9)20-18-47(79(6,7)44(81)17-21-82(45,10)83(35,11)25-46(84)90)119-72-59(102)55(98)52(95)43(117-72)32-114-74-65(50(93)39(88)29-113-74)122-70-58(101)49(92)38(87)28-111-70/h12,14-15,34,36-67,69-76,85-105,108H,1,13,16-32H2,2-11H3/b33-14-/t34-,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 | AEPZIZXGVQDNGR-YLZODVGFSA-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 | 1799.963 g/mol |
Solvent | C5D5N |
Source File Reference | UWMZ23120 |