| SpectraBase Compound ID | 4v95Jdi82Tv |
|---|---|
| InChI | InChI=1S/C44H68O17/c1-19(20(2)40(55)61-42-39(37(53)34(50)31(17-45)58-42)60-41-38(54)36(52)35(51)32(59-41)18-56-22(4)46)14-30(57-23(5)47)21(3)27-10-11-28-26-9-8-24-15-25(48)16-33(49)44(24,7)29(26)12-13-43(27,28)6/h8,21,25-39,41-42,45,48-54H,9-18H2,1-7H3/b20-19+/t21-,25+,26?,27+,28?,29?,30?,31-,32-,33-,34-,35-,36+,37+,38-,39-,41+,42+,43+,44-/m0/s1 |
| InChIKey | TXDGMLOFAWWZMG-MBZJJGKVSA-N |
| Mol Weight | 869.0 g/mol |
| Molecular Formula | C44H68O17 |
| Exact Mass | 868.445651 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 68qZE0QLZiX |
|---|---|
| Name | TXDGMLOFAWWZMG-MBZJJGKVSA-N |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H68O17 |
| InChI | InChI=1S/C44H68O17/c1-19(20(2)40(55)61-42-39(37(53)34(50)31(17-45)58-42)60-41-38(54)36(52)35(51)32(59-41)18-56-22(4)46)14-30(57-23(5)47)21(3)27-10-11-28-26-9-8-24-15-25(48)16-33(49)44(24,7)29(26)12-13-43(27,28)6/h8,21,25-39,41-42,45,48-54H,9-18H2,1-7H3/b20-19+/t21-,25+,26?,27+,28?,29?,30?,31-,32-,33-,34-,35-,36+,37+,38-,39-,41+,42+,43+,44-/m0/s1 |
| InChIKey | TXDGMLOFAWWZMG-MBZJJGKVSA-N |
| Literature Reference Author | A.C.WAISS,C.A.ELLIGER,W.F.HADDON,M.BENSON |
| Literature Reference Citation | J.NAT.PROD.,56,1365(1993) |
| Literature Reference DOI | 10.1021/np50098a021 |
| Molecular Weight | 869.014 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCS18508 |