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HOOKEROSIDE-B;3-O-BETA-D-XYLOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-XYLOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-XYLOPY
SpectraBase Compound ID 6WDz3FYFF9S
InChI InChI=1S/C69H112O34/c1-26-38(74)54(101-58-48(84)43(79)34(25-93-58)97-59-51(87)46(82)53(32(21-71)96-59)100-57-47(83)39(75)29(72)22-90-57)52(88)61(94-26)102-55-40(76)30(73)23-91-62(55)99-37-12-13-66(6)35(65(37,4)5)11-14-68(8)36(66)10-9-27-28-19-64(2,3)15-17-69(28,18-16-67(27,68)7)63(89)103-60-50(86)45(81)42(78)33(98-60)24-92-56-49(85)44(80)41(77)31(20-70)95-56/h9,26,28-62,70-88H,10-25H2,1-8H3/t26-,28-,29-,30+,31+,32+,33+,34+,35-,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-,66?,67?,68?,69-/m0/s1
InChIKey REHKXYHSPOHRPZ-OOCJVAAQSA-N
Mol Weight 1485.6 g/mol
Molecular Formula C69H112O34
Exact Mass 1484.703501 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1xZqku0tRMg
Name HOOKEROSIDE-B;3-O-BETA-D-XYLOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-XYLOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-XYLOPY
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C69H112O34
InChI InChI=1S/C69H112O34/c1-26-38(74)54(101-58-48(84)43(79)34(25-93-58)97-59-51(87)46(82)53(32(21-71)96-59)100-57-47(83)39(75)29(72)22-90-57)52(88)61(94-26)102-55-40(76)30(73)23-91-62(55)99-37-12-13-66(6)35(65(37,4)5)11-14-68(8)36(66)10-9-27-28-19-64(2,3)15-17-69(28,18-16-67(27,68)7)63(89)103-60-50(86)45(81)42(78)33(98-60)24-92-56-49(85)44(80)41(77)31(20-70)95-56/h9,26,28-62,70-88H,10-25H2,1-8H3/t26-,28-,29-,30+,31+,32+,33+,34+,35-,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-,66?,67?,68?,69-/m0/s1
InChIKey REHKXYHSPOHRPZ-OOCJVAAQSA-N
Literature Reference Author J.TIAN,F.E.WU,M.H.QIU,R.L.NIE
Literature Reference Citation PHYTOCHEM.,32,1535(1993)
Literature Reference DOI 10.1016/0031-9422(93)85174-P
Molecular Weight 1485.628 g/mol
Solvent C5D5N
Source File Reference UWLU6625