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LADYGINOSIDE-F;3-O-BETA-[GLUCOPYRANOSYL-(1->4)-GLUCURONOPYRANOSYL]-HEDERAGENIN-28-O-[GLUCOPYRANOSYL-(1->6)-GLUCOPYRANOSYL-(1->6)-[GALACTOPYRANOSY
SpectraBase Compound ID 7RBRhLTf1II
InChI InChI=1S/C72H116O40/c1-67(2)13-15-72(16-14-70(5)25(26(72)17-67)7-8-34-68(3)11-10-35(69(4,24-76)33(68)9-12-71(34,70)6)108-65-54(95)47(88)56(57(111-65)58(96)97)110-63-51(92)43(84)38(79)29(20-75)104-63)66(98)112-64-52(93)45(86)40(81)31(106-64)22-100-61-53(94)46(87)55(109-62-50(91)42(83)37(78)28(19-74)103-62)32(107-61)23-101-60-49(90)44(85)39(80)30(105-60)21-99-59-48(89)41(82)36(77)27(18-73)102-59/h7,26-57,59-65,73-95H,8-24H2,1-6H3,(H,96,97)/t26?,27-,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-,59-,60-,61-,62-,63+,64-,65+,68-,69-,70+,71+,72-/m0/s1
InChIKey ARCYVHYCZIANOD-ZXIMMJNCSA-N
Mol Weight 1621.7 g/mol
Molecular Formula C72H116O40
Exact Mass 1620.704288 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4FK8wfQXe5P
Name LADYGINOSIDE-F;3-O-BETA-[GLUCOPYRANOSYL-(1->4)-GLUCURONOPYRANOSYL]-HEDERAGENIN-28-O-[GLUCOPYRANOSYL-(1->6)-GLUCOPYRANOSYL-(1->6)-[GALACTOPYRANOSY
Compound Number 101
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C72H116O40
InChI InChI=1S/C72H116O40/c1-67(2)13-15-72(16-14-70(5)25(26(72)17-67)7-8-34-68(3)11-10-35(69(4,24-76)33(68)9-12-71(34,70)6)108-65-54(95)47(88)56(57(111-65)58(96)97)110-63-51(92)43(84)38(79)29(20-75)104-63)66(98)112-64-52(93)45(86)40(81)31(106-64)22-100-61-53(94)46(87)55(109-62-50(91)42(83)37(78)28(19-74)103-62)32(107-61)23-101-60-49(90)44(85)39(80)30(105-60)21-99-59-48(89)41(82)36(77)27(18-73)102-59/h7,26-57,59-65,73-95H,8-24H2,1-6H3,(H,96,97)/t26?,27-,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-,59-,60-,61-,62-,63+,64-,65+,68-,69-,70+,71+,72-/m0/s1
InChIKey ARCYVHYCZIANOD-ZXIMMJNCSA-N
Literature Reference Author N.TAN,J.ZHOU,S.ZHAO
Literature Reference Citation PHYTOCHEM.,52,153(1999)
Literature Reference DOI 10.1016/S0031-9422(98)00454-3
Molecular Weight 1621.689 g/mol
Solvent C5D5N
Source File Reference UWVN1145