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PRATIOSIDE
SpectraBase Compound ID EaVfqyReHnd
InChI InChI=1S/C51H84O25/c1-20(19-68-44-39(63)35(59)32(56)27(15-52)70-44)7-12-50(66)21(2)51(67)31(76-50)14-26-24-6-5-22-13-23(8-10-48(22,3)25(24)9-11-49(26,51)4)69-45-41(65)38(62)42(30(18-55)73-45)74-47-43(37(61)34(58)29(17-54)72-47)75-46-40(64)36(60)33(57)28(16-53)71-46/h5,20-21,23-47,52-67H,6-19H2,1-4H3/t20-,21-,23+,24-,25+,26+,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-/m1/s1
InChIKey LGPHZPODBOTJSA-AZMXVEMLSA-N
Mol Weight 1097.2 g/mol
Molecular Formula C51H84O25
Exact Mass 1096.530168 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2d7sKoV0arL
Name PRATIOSIDE
Compound Number 117
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C51H84O25
InChI InChI=1S/C51H84O25/c1-20(19-68-44-39(63)35(59)32(56)27(15-52)70-44)7-12-50(66)21(2)51(67)31(76-50)14-26-24-6-5-22-13-23(8-10-48(22,3)25(24)9-11-49(26,51)4)69-45-41(65)38(62)42(30(18-55)73-45)74-47-43(37(61)34(58)29(17-54)72-47)75-46-40(64)36(60)33(57)28(16-53)71-46/h5,20-21,23-47,52-67H,6-19H2,1-4H3/t20-,21-,23+,24-,25+,26+,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-/m1/s1
InChIKey LGPHZPODBOTJSA-AZMXVEMLSA-N
Literature Reference Author P.K.AGRAWAL,D.C.JAIN,A.K.PATHAK
Literature Reference Citation MAGN.RES.CHEM.,33,923(1995)
Literature Reference DOI 10.1002/mrc.1260331202
Molecular Weight 1097.213 g/mol
Solvent C5D5N
Source File Reference UWCS22205