| SpectraBase Compound ID | 2gkPxQdEiW0 |
|---|---|
| InChI | InChI=1S/C45H62O20/c1-17-15-57-45(41(55)35(17)59-19(3)47)28(14-46)32-26-10-11-27-25(31(26)34(54)37(32)65-45)9-8-23-12-24(51)13-30(44(23,27)7)63-42-38(33(53)29(52)16-56-42)64-43-40(62-22(6)50)39(61-21(5)49)36(18(2)58-43)60-20(4)48/h8,17-18,24-25,27-30,32-33,35-43,46,51-53,55H,9-16H2,1-7H3/t17-,18+,24+,25+,27-,28-,29+,30+,32-,33+,35-,36+,37+,38-,39-,40-,41-,42+,43+,44-,45-/m0/s1 |
| InChIKey | MOHVWFIQTCFJBP-YKSZOBAFSA-N |
| Mol Weight | 923.0 g/mol |
| Molecular Formula | C45H62O20 |
| Exact Mass | 922.383444 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ITAL13pnby7 |
|---|---|
| Name | MOHVWFIQTCFJBP-YKSZOBAFSA-N |
| Compound Number | 97 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H62O20 |
| InChI | InChI=1S/C45H62O20/c1-17-15-57-45(41(55)35(17)59-19(3)47)28(14-46)32-26-10-11-27-25(31(26)34(54)37(32)65-45)9-8-23-12-24(51)13-30(44(23,27)7)63-42-38(33(53)29(52)16-56-42)64-43-40(62-22(6)50)39(61-21(5)49)36(18(2)58-43)60-20(4)48/h8,17-18,24-25,27-30,32-33,35-43,46,51-53,55H,9-16H2,1-7H3/t17-,18+,24+,25+,27-,28-,29+,30+,32-,33+,35-,36+,37+,38-,39-,40-,41-,42+,43+,44-,45-/m0/s1 |
| InChIKey | MOHVWFIQTCFJBP-YKSZOBAFSA-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 | 922.975 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS22185 |