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15-BETA-HYDROXYLINEOLON-3-O-BETA-D-[OLEANDROPYRANOSYL-(1->4)-DIGITOXOPYRANOSYL-(1->4)-DIGITOXOPYRANOSYL-(1->4)-DIGITOXOPYRANOSIDE]
SpectraBase Compound ID A7XeoPquVDs
InChI InChI=1S/C46H74O18/c1-20(47)27-14-34(52)46(55)44(27,7)33(51)19-32-43(6)11-10-26(13-25(43)9-12-45(32,46)54)61-35-15-28(48)40(22(3)58-35)62-36-16-29(49)41(23(4)59-36)63-37-17-30(50)42(24(5)60-37)64-38-18-31(56-8)39(53)21(2)57-38/h9,21-24,26-42,48-55H,10-19H2,1-8H3/t21-,22-,23-,24-,26-,27-,28+,29+,30+,31-,32+,33+,34+,35+,36+,37+,38+,39-,40-,41-,42-,43-,44-,45-,46+/m0/s1
InChIKey YCBRHLKSYIBRIR-RPJGETATSA-N
Mol Weight 915.1 g/mol
Molecular Formula C46H74O18
Exact Mass 914.487516 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9kQEqHOFie5
Name 15-BETA-HYDROXYLINEOLON-3-O-BETA-D-[OLEANDROPYRANOSYL-(1->4)-DIGITOXOPYRANOSYL-(1->4)-DIGITOXOPYRANOSYL-(1->4)-DIGITOXOPYRANOSIDE]
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H74O18
InChI InChI=1S/C46H74O18/c1-20(47)27-14-34(52)46(55)44(27,7)33(51)19-32-43(6)11-10-26(13-25(43)9-12-45(32,46)54)61-35-15-28(48)40(22(3)58-35)62-36-16-29(49)41(23(4)59-36)63-37-17-30(50)42(24(5)60-37)64-38-18-31(56-8)39(53)21(2)57-38/h9,21-24,26-42,48-55H,10-19H2,1-8H3/t21-,22-,23-,24-,26-,27-,28+,29+,30+,31-,32+,33+,34+,35+,36+,37+,38+,39-,40-,41-,42-,43-,44-,45-,46+/m0/s1
InChIKey YCBRHLKSYIBRIR-RPJGETATSA-N
Literature Reference Author T.WARASHINA,T.NORO
Literature Reference Citation PHYTOCHEM.,53,485(2000)
Literature Reference DOI 10.1016/S0031-9422(99)00560-9
Molecular Weight 915.083 g/mol
Solvent C5D5N
Source File Reference UWLU2044