| 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
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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 |