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LONICEROSIDE-A;#1;3-O-ALPHA-L-ARABINOPYRANOSYL-HEDERAGENIN-28-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSYLESTER
SpectraBase Compound ID 29T80Cq0fPP
InChI InChI=1S/C52H84O21/c1-23-32(56)36(60)40(64)44(69-23)72-41-37(61)35(59)28(21-68-42-38(62)33(57)26(54)19-66-42)70-45(41)73-46(65)52-16-14-47(2,3)18-25(52)24-8-9-30-48(4)12-11-31(71-43-39(63)34(58)27(55)20-67-43)49(5,22-53)29(48)10-13-51(30,7)50(24,6)15-17-52/h8,23,25-45,53-64H,9-22H2,1-7H3/t23-,25-,26+,27-,28+,29+,30+,31-,32-,33-,34-,35+,36+,37-,38+,39+,40+,41+,42-,43-,44-,45-,48?,49-,50?,51?,52-/m0/s1
InChIKey AWVAONKHWVCQKJ-VKJHOONQSA-N
Mol Weight 1045.2 g/mol
Molecular Formula C52H84O21
Exact Mass 1044.55051 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AdnjvPW0i0n
Name LONICEROSIDE-A;#1;3-O-ALPHA-L-ARABINOPYRANOSYL-HEDERAGENIN-28-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSYLESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H84O21
InChI InChI=1S/C52H84O21/c1-23-32(56)36(60)40(64)44(69-23)72-41-37(61)35(59)28(21-68-42-38(62)33(57)26(54)19-66-42)70-45(41)73-46(65)52-16-14-47(2,3)18-25(52)24-8-9-30-48(4)12-11-31(71-43-39(63)34(58)27(55)20-67-43)49(5,22-53)29(48)10-13-51(30,7)50(24,6)15-17-52/h8,23,25-45,53-64H,9-22H2,1-7H3/t23-,25-,26+,27-,28+,29+,30+,31-,32-,33-,34-,35+,36+,37-,38+,39+,40+,41+,42-,43-,44-,45-,48?,49-,50?,51?,52-/m0/s1
InChIKey AWVAONKHWVCQKJ-VKJHOONQSA-N
Literature Reference Author K.H.SON,K.Y.JUNG,H.W.CHANG,H.P.KIM,S.S.KANG
Literature Reference Citation PHYTOCHEM.,35,1005(1994)
Literature Reference DOI 10.1016/S0031-9422(00)90656-3
Molecular Weight 1045.226 g/mol
Solvent C5D5N
Source File Reference UWMS24410