| SpectraBase Compound ID | AsdebqU6IsX |
|---|---|
| InChI | InChI=1S/C44H76N2O15/c1-25(2)21-34(50)59-42-29(6)56-36(24-44(42,8)53)60-39-28(5)57-43(38(52)37(39)46(9)10)61-40-31(17-18-45-19-20-47)22-26(3)32(49)16-14-12-13-15-27(4)55-35(51)23-33(41(40)54-11)58-30(7)48/h12-14,16,25-29,31-33,36-43,45,47,49,52-53H,15,17-24H2,1-11H3/b13-12+,16-14+/t26-,27-,28-,29+,31+,32+,33-,36+,37-,38-,39-,40+,41+,42+,43+,44-/m1/s1 |
| InChIKey | DIARPZLZSGPCFY-OELMQVAZSA-N |
| Mol Weight | 873.1 g/mol |
| Molecular Formula | C44H76N2O15 |
| Exact Mass | 872.52457 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7OBujR28AZS |
|---|---|
| Name | DIARPZLZSGPCFY-OELMQVAZSA-N |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H76N2O15 |
| InChI | InChI=1S/C44H76N2O15/c1-25(2)21-34(50)59-42-29(6)56-36(24-44(42,8)53)60-39-28(5)57-43(38(52)37(39)46(9)10)61-40-31(17-18-45-19-20-47)22-26(3)32(49)16-14-12-13-15-27(4)55-35(51)23-33(41(40)54-11)58-30(7)48/h12-14,16,25-29,31-33,36-43,45,47,49,52-53H,15,17-24H2,1-11H3/b13-12+,16-14+/t26-,27-,28-,29+,31+,32+,33-,36+,37-,38-,39-,40+,41+,42+,43+,44-/m1/s1 |
| InChIKey | DIARPZLZSGPCFY-OELMQVAZSA-N |
| Literature Reference Author | P.PRZYBYLSKI,K.PYTA,J.STEFANSKA,B.BRZEZINSKI,F.BARTL |
| Literature Reference Citation | MAGN.RES.CHEM.,48,286(2010) |
| Literature Reference DOI | 10.1002/mrc.2574 |
| Molecular Weight | 873.092 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWIR16531 |